SCHEMBL856509

SCHEMBL856509

CC(=O)c1ccc(CN)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.67
LOXL2 Q9Y4K0 2/20 0.61
LMNA P02545 2/20 0.57
HDAC3 O15379 1/20 0.57
HDAC6 Q9UBN7 1/20 0.57
NCOR2 Q9Y618 1/20 0.57
F10 P00742 1/20 0.52
HSD17B10 Q99714 1/20 0.52
KDM4E B2RXH2 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
SMYD3 Q9H7B4 1/20 0.49
NOS3 P29474 4/20 0.48
NOS1 P29475 4/20 0.48
NOS2 P35228 2/20 0.48
HPGD P15428 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
MAPT P10636 1/20 0.48
RAB9A P51151 1/20 0.48
ABAT P80404 1/20 0.48
PYCR1 P32322 1/20 0.47

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 SCHEMBL7398643 0.98 KMT2A (0.64) KMT2ALOXL2LMNAHDAC3HDAC6
Ethylene SCHEMBL11090983 0.96 KMT2A (0.61) KMT2ALOXL2LMNAHDAC3HDAC6
SCHEMBL27361738 0.94 KMT2A (0.59) KMT2ALOXL2LMNAHDAC3HDAC6
Trifluoroacetic Acid SCHEMBL1823273 0.87 KMT2A (0.52) KMT2ALOXL2LMNAHDAC3HDAC6
Acetophenone SCHEMBL27933326 0.85 LMNA (0.62) KMT2ALOXL2LMNAKDM4ESMN1; SMN2
SCHEMBL8269164 0.84 EPHX2 (0.69) KMT2AHDAC3HDAC6NCOR2MAPT
SCHEMBL378134 0.82 KMT2A (0.61) KMT2ALMNAHSD17B10KDM4ENOS3
SCHEMBL17132765 0.82 KMT2A (0.61) KMT2ALOXL2LMNAHSD17B10SMN1; SMN2
Hydrochloric Acid SCHEMBL7400678 0.80 KMT2A (0.59) KMT2ALMNAHSD17B10KDM4ENOS3
SCHEMBL6859304 0.80 KMT2A (1.00) KMT2ALMNAHSD17B10SMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2033662-B1 Transglutaminase mediated conjugation of peptides NOVO NORDISK HEALTHCARE AG (CH) 2012-10-17 EP claimed
US-20230391794-A1 MAYTANSINOID-BASED DRUG DELIVERY SYSTEMS CENTURION BIOPHARMA CORPORATION 2023-12-07 US disclosed
CN-116986985-A Chalcone derivative and application thereof 广州医科大学 2023-11-03 CN disclosed
WO-2023171448-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING DISEASE TO BE PREVENTED OR TREATED BY DEACTIVATION OF MYOFIBROBLASTS 学校法人東海大学 2023-09-14 WO disclosed
US-20230159554-A1 COMPOUND WITH ANTICANCER ACTIVITY KYOWA KIRIN CO., LTD. (JP) 2023-05-25 US disclosed
US-11584747-B2 Substituted pyridopyrimidinonyl compounds useful as T cell activators SYNGENE INTERNATIONAL LIMITED (IN) 2023-02-21 US disclosed
US-11572373-B2 Maytansinoid-based drug delivery systems LADRX CORPORATION (US) 2023-02-07 US disclosed
WO-2021062246-A1 CRF RECEPTOR ANTAGONISTS AND METHODS OF USE NEUROCRINE BIOSCIENCES, INC. (US) 2021-04-01 WO disclosed
WO-2021041588-A1 SUBSTITUTED PYRIDOPYRIMIDINONYL COMPOUNDS USEFUL AS T CELL ACTIVATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2021-03-04 WO disclosed
US-20210061802-A1 SUBSTITUTED PYRIDOPYRIMIDINONYL COMPOUNDS USEFUL AS T CELL ACTIVATORS SYNGENE INTERNATIONAL LIMITED (IN) 2021-03-04 US disclosed
US-7176279-B2 Cyclic peptide compositions and methods for treatment of sexual dysfunction PALATIN TECHNOLOGIES, INC. (US) 2007-02-13 US disclosed
US-20060258701-A1 Novel 2-pyridinecarboxamide derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-11-16 US disclosed
EP-0882715-B1 NOVEL N-(UNSUBSTITUTED OR SUBSTITUTED)-4-SUBSTITUTED-6-(UNSUBSTITUTED OR SUBSTITUTED)PHENOXY-2-PYRIDINECARBOXAMIDES OR THIOCARBOXAMIDES, PROCESSES FOR PRODUCING THE SAME, AND HERBICIDES KUREHA CHEMICAL IND CO LTD (JP) 2003-04-23 EP disclosed
US-6339045-B1 CAN BE USED IN A SMALL AMOUNT, SHOWING A GOOD SELECTIVITY BETWEEN CROP AND WEED, AND CAUSING NO PHYTOTOXICITY KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2002-01-15 US disclosed
WO-2000023444-A1 5,7-DISUBSTITUTED-4-AMINOPYRIDO[2,3-D]PYRIMIDINE COMPOUNDS ABBOTT LABORATORIES (US) 2000-04-27 WO disclosed
EP-0989986-A1 5,7-DISUBSTITUTED 4-AMINOPYRIDO 2,3-D]PYRIMIDINE COMPOUNDS AND THEIR USE AS ADENOSINE KINASE INHIBITORS Abbott Laboratories (US) 2000-04-05 EP disclosed
CN-1218399-A Benzamide treatment of dementia associated with AIDs virus (HIV-4) infection CENTAUR PHARMACEUTICALS INC (US) 1999-06-02 CN disclosed
EP-0882715-A1 NOVEL N-(UNSUBSTITUTED OR SUBSTITUTED)-4-SUBSTITUTED-6-(UNSUBSTITUTED OR SUBSTITUTED)PHENOXY-2-PYRIDINECARBOXAMIDES OR THIOCARBOXAMIDES, PROCESSES FOR PRODUCING THE SAME, AND HERBICIDES KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1998-12-09 EP disclosed
WO-1998046605-A1 5,7-DISUBSTITUTED 4-AMINOPYRIDO[2,3-D]PYRIMIDINE COMPOUNDS AND THEIR USE AS ADENOSINE KINASE INHIBITORS ABBOTT LABORATORIES (US) 1998-10-22 WO disclosed
EP-0031794-A2 Cephalosporin derivatives, process for their preparation and pharmaceutical compositions containing them CIBA-GEIGY AG (CH) 1981-07-08 EP 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 (6 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-11584747-B2 Substituted pyridopyrimidinonyl compounds useful as T cell activators DGKZ, DGKA, DGKG KMT2A 2162/4885LOXL2 3987/4885LMNA 2876/4885
US-20210061802-A1 SUBSTITUTED PYRIDOPYRIMIDINONYL COMPOUNDS USEFUL AS T CELL ACTIVATORS DGKZ, DGKA, DGKG KMT2A 2162/4885LOXL2 3987/4885LMNA 2876/4885
US-20230391794-A1 MAYTANSINOID-BASED DRUG DELIVERY SYSTEMS SLC6A2, SLC6A7, SLC6A4 KMT2A 4652/4885LOXL2 3331/4885LMNA 3527/4885
US-20230159554-A1 COMPOUND WITH ANTICANCER ACTIVITY TP53, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, RCC2 KMT2A 2349/4885LOXL2 2834/4885LMNA 1695/4885
US-11572373-B2 Maytansinoid-based drug delivery systems SLC6A2, SLC6A7, SLC6A4 KMT2A 4652/4885LOXL2 3331/4885LMNA 3527/4885
US-20060258701-A1 Novel 2-pyridinecarboxamide derivatives GCKR, GCK, HK2 KMT2A 1311/4885LOXL2 2252/4885LMNA 4724/4885

“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.