SCHEMBL1056733

SCHEMBL1056733

O=C(NNc1nc2cc(F)ccc2n2cccc12)c1cnccn1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.44
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HKDC1 Q2TB90 1/20 0.42
RAD51 Q06609 2/20 0.41
HTR3E A5X5Y0 2/20 0.40
HTR3B O95264 2/20 0.40
HTR3A P46098 2/20 0.40
HTR3D Q70Z44 2/20 0.40
HTR3C Q8WXA8 2/20 0.40
MEN1 O00255 1/20 0.39
CDC25A P30304 1/20 0.39
CDC25B P30305 1/20 0.39
CDC25C P30307 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL1147705 0.99 MAOB (0.43) MAOBKDM4EALDH1A1SMN1; SMN2HKDC1
Hydrochloric Acid SCHEMBL1147531 0.87 TLR7 (0.45) SMN1; SMN2RAD51HTR3EHTR3BHTR3A
Hydrochloric Acid SCHEMBL1147720 0.85 POLB (0.44) KDM4EALDH1A1SMN1; SMN2RAD51HTR3E
SCHEMBL1147798 0.84 NPC1 (0.44) KDM4ESMN1; SMN2MEN1KMT2A
Hydrochloric Acid SCHEMBL1147776 0.83 SMN1; SMN2 (0.40) SMN1; SMN2RAD51HTR3EHTR3BHTR3A
Hydrochloric Acid SCHEMBL1147695 0.81 OPRK1 (0.39) MAOBKDM4EALDH1A1SMN1; SMN2HKDC1
Hydrochloric Acid SCHEMBL1147787 0.78 HTR3E (0.44) SMN1; SMN2RAD51HTR3EHTR3BHTR3A
Hydrochloric Acid SCHEMBL1147803 0.78 KDM4E (0.43) KDM4EALDH1A1SMN1; SMN2RAD51HTR3E
SCHEMBL1147833 0.74 OPRK1 (0.47) KDM4EALDH1A1HTR3EHTR3BHTR3A
SCHEMBL4522606 0.74 NPC1 (0.51) MAOBKDM4EALDH1A1SMN1; SMN2MEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 95 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3700514-B1 COMBINATION OF IL-8 INHIBITORS AND IL-6/GP-130 INHIBITORS FOR USE IN THE TREATMENT OF LUNG METASTASIS ASSOCIATED TO OSTEOSARCOMA DOMPE FARM SPA (IT) 2025-03-19 EP claimed
US-11999699-B2 Substituted pyrazole amides Grünenthal GmbH (DE) 2024-06-04 US claimed
EP-4355733-A1 SUBSTITUTED PYRAZOLE AMIDES Grünenthal GmbH (DE) 2024-04-24 EP claimed
EP-4277978-A1 BLASTOCYST-LIKE CELL AGGREGATE AND METHODS IMBA-Institut für Molekulare Biotechnologie GmbH (AT) 2023-11-22 EP claimed
CN-116806258-A Blastocyst-like cell aggregates and methods IMBA-莫利库尔生物技术研究所 2023-09-26 CN claimed
US-20230025025-A1 SUBSTITUTED PYRAZOLE AMIDES GRUENENTHAL GMBH (DE) 2023-01-26 US claimed
WO-2022263498-A1 SUBSTITUTED PYRAZOLE AMIDES Grünenthal GmbH (DE) 2022-12-22 WO claimed
WO-2022152774-A1 BLASTOCYST-LIKE CELL AGGREGATE AND METHODS IMBA - INSTITUT FÜR MOLEKULARE BIOTECHNOLOGIE GMBH (AT) 2022-07-21 WO claimed
US-20220054485-A1 METHODS OF TREATING RIGHT VENTRICULAR FUNCTION IN PULMONARY HYPERTENSION REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2022-02-24 US claimed
US-8058437-B2 (Pyrroloquinoxalinyl) pyrazinecarbohydrazide-oxalic acid co-crystal for treatment of cancer and other diseases NOVELIX PHARMACEUTICALS, INC. (US) 2011-11-15 US claimed
US-20110034473-A1 NOVEL (PYRROLOQUINOXALINYL) PYRAZINECARBOHYDRAZIDE-OXALIC ACID CO-CRYSTAL FOR TREATMENT OF CANCER AND OTHER DISEASES NOVELIX PHARMACEUTICALS, INC. (US) 2011-02-10 US claimed
EP-2276490-A1 NOVEL (PYRROLOQUINOXALINYL) PYRAZINECARBOHYDRAZIDE-OXALIC ACID CO-CRYSTAL FOR TREATMENT OF CANCER AND OTHER DISEASES Novelix Pharmaceuticals, Inc. (US) 2011-01-26 EP claimed
WO-2009126743-A1 NOVEL (PYRROLOQUINOXALINYL) PYRAZINECARBOHYDRAZIDE-OXALIC ACID CO-CRYSTAL FOR TREATMENT OF CANCER AND OTHER DISEASES NOVELIX PHARMACEUTICALS, INC. (US) 2009-10-15 WO claimed
EP-3845962-B1 DISPLAY PANEL AND DISPLAY DEVICE COMPRISING SAME SAMSUNG DISPLAY CO LTD (KR) 2026-05-13 EP disclosed
US-20260092179-A1 GENETICALLY MODIFIED HOST CELLS PRODUCING VIOLACEIN, ANALOGUES, AND DERIVATIVES THEREOF OCTARINE BIO APS (DK) 2026-04-02 US disclosed
US-12577238-B2 Compositions and methods for modulating inflammatory and degenerative disorder UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2026-03-17 US disclosed
US-20090093489-A1 NOVEL COMPOUNDS FOR TREATMENT OF CANCER AND DISORDERS ASSOCIATED WITH ANGIOGENESIS FUNCTION UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2009-04-09 US disclosed
US-20090093489-A1 NOVEL COMPOUNDS FOR TREATMENT OF CANCER AND DISORDERS ASSOCIATED WITH ANGIOGENESIS FUNCTION UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2009-04-09 US disclosed
US-20060235034-A1 Novel compounds for treatment of cancer and disorders associated with angiogenesis function UNIVERSITY OF SOUTHERN CALIFORNIA 2006-10-19 US disclosed
US-20060142294-A1 Novel compounds for treatment of cancer and disorders associated with angiogenesis function UNIVERSITY OF SOUTHERN CALIFORNIA 2006-06-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060142294-A1 Novel compounds for treatment of cancer and disorders associated with angiogenesis function VEGFA, TEK, LIPG MAOB 1741/4885KDM4E 3815/4885ALDH1A1 1365/4885
US-11999699-B2 Substituted pyrazole amides SCN8A, SCN1A, SCN7A MAOB 2124/4885KDM4E 2803/4885ALDH1A1 834/4885
US-20110034473-A1 NOVEL (PYRROLOQUINOXALINYL) PYRAZINECARBOHYDRAZIDE-OXALIC ACID CO-CRYSTAL FOR TREATMENT OF CANCER AND OTHER DISEASES PDXK, OTC, XDH MAOB 851/4885KDM4E 3090/4885ALDH1A1 1416/4885
US-20260092179-A1 GENETICALLY MODIFIED HOST CELLS PRODUCING VIOLACEIN, ANALOGUES, AND DERIVATIVES THEREOF TDO2, BLVRB, INMT MAOB 300/4885KDM4E 1143/4885ALDH1A1 1612/4885
US-12577238-B2 Compositions and methods for modulating inflammatory and degenerative disorder TNF, TNFSF11, CD40 MAOB 2892/4885KDM4E 4035/4885ALDH1A1 2788/4885
US-20090093489-A1 NOVEL COMPOUNDS FOR TREATMENT OF CANCER AND DISORDERS ASSOCIATED WITH ANGIOGENESIS FUNCTION VEGFA, TEK, MCL1 MAOB 2037/4885KDM4E 3554/4885ALDH1A1 1558/4885
US-20060235034-A1 Novel compounds for treatment of cancer and disorders associated with angiogenesis function VEGFA, TEK, MCL1 MAOB 2037/4885KDM4E 3554/4885ALDH1A1 1558/4885
US-20230025025-A1 SUBSTITUTED PYRAZOLE AMIDES SCN8A, SCN1A, SCN7A MAOB 2124/4885KDM4E 2803/4885ALDH1A1 834/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.