SCHEMBL2570944

SCHEMBL2570944

COC(=O)c1ccc2c(c1)ncn2-c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 11/20 1.00
SRC P12931 1/20 0.64
RAB9A P51151 3/20 0.61
NPC1 O15118 2/20 0.61
HPGD P15428 2/20 0.60
LMNA P02545 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
MAPT P10636 1/20 0.56
KDR P35968 1/20 0.55
GSK3B P49841 1/20 0.55

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
SCHEMBL5820178 0.90 FGFR1 (0.81) FGFR1SRCRAB9ANPC1HPGD
SCHEMBL7975748 0.89 FGFR1 (0.81) FGFR1SRCRAB9AHPGDMAPT
Hydrochloric Acid SCHEMBL7986510 0.88 FGFR1 (0.79) FGFR1SRCRAB9AHPGDMAPT
SCHEMBL4502855 0.88 FGFR1 (0.79) FGFR1RAB9AHPGDMAPTGSK3B
SCHEMBL23675157 0.87 FGFR1 (0.77) FGFR1HPGD
SCHEMBL2340072 0.87 FGFR1 (0.77) FGFR1RAB9AHPGDSMN1; SMN2MAPT
SCHEMBL14065339 0.87 FGFR1 (0.77) FGFR1RAB9ANPC1HPGDMAPT
SCHEMBL23675303 0.87 FGFR1 (0.77) FGFR1RAB9ANPC1HPGDSMN1; SMN2
SCHEMBL144945 0.87 FGFR1 (0.77) FGFR1RAB9ANPC1HPGDMAPT
SCHEMBL6875300 0.86 FGFR1 (0.76) FGFR1RAB9ANPC1HPGDSMN1; SMN2

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8193224-B2 Medicinal composition for prevention or treatment of parasitic protozoan infection FUJIFILM CORPORATION (JP) 2012-06-05 US disclosed
EP-1818334-B1 ANTI-TRYPANOSOMIASIS AGENT IHARA MASATAKA (JP) 2011-11-02 EP disclosed
US-7795285-B2 Anti-trypanosomiasis agent FUJIFILM CORPORATION (JP) 2010-09-14 US disclosed
US-20100113789-A1 MEDICINAL COMPOSITION FOR PREVENTION OR TREATMENT OF PARASITIC PROTOZOAN INFECTION Ihara, Masataka (JP) 2010-05-06 US disclosed
US-20090076067-A1 PHARMACEUTICAL COMPOSITION COMPRISING AZARHODACYANINE COMPOUND AS ACTIVE INGREDIENT JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2009-03-19 US disclosed
EP-1894920-A1 PHARMACEUTICAL COMPOSITION COMPRISING AZARHODACYANINE COMPOUND AS ACTIVE INGREDIENT Japan Science and Technology Agency (JP) 2008-03-05 EP disclosed
US-20080045574-A1 thiazolidin-4-one derivatives used as antiprotozoa agents, or for the treatment of trypanosomiasis JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2008-02-21 US disclosed
EP-1818334-A1 ANTI-TRYPANOSOMIASIS AGENT Japan Science and Technology Agency (JP) 2007-08-15 EP disclosed
EP-1800682-A1 MEDICINAL COMPOSITION FOR PREVENTION OR TREATMENT OF PARASITIC PROTOZOAN INFECTION Japan Science and Technology Agency (JP) 2007-06-27 EP disclosed
US-6218388-B1 THERAPY OF PROTEIN TYROSINE KINASE MEDIATED CANCER, ATHEROSCLEROSIS, RESTENOSIS, AND PSORIASIS BY ADMINISTERING BENZIMIDAZOLE DERIVATIVE WARNER-LAMBERT COMPANY 2001-04-17 US disclosed
US-5990146-A TREATING PROTEIN TYROSINE KINASE MEDIATED CANCER; ANTICARCINOGENIC AGENTS; ATHEROSCLEROSIS; RESTENOSIS; PSORIASIS; ANTIPROLIFERATIVE AGENTS WARNER-LAMBERT COMPANY (US) 1999-11-23 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 (3 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-20090076067-A1 PHARMACEUTICAL COMPOSITION COMPRISING AZARHODACYANINE COMPOUND AS ACTIVE INGREDIENT CTSA, GPAA1, CD47 FGFR1 4728/4885SRC 2384/4885RAB9A 1006/4885
US-20080045574-A1 thiazolidin-4-one derivatives used as antiprotozoa agents, or for the treatment of trypanosomiasis TXN2, SQOR, TXNRD2 FGFR1 4572/4885SRC 4150/4885RAB9A 2331/4885
US-20100113789-A1 MEDICINAL COMPOSITION FOR PREVENTION OR TREATMENT OF PARASITIC PROTOZOAN INFECTION MRM1, NR1I3, RORA FGFR1 4373/4885SRC 1223/4885RAB9A 1644/4885

“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.