SCHEMBL1129103

SCHEMBL1129103

CC1(C)OB(c2ccc3c(c2)ncn3-c2ccccc2)OC1(C)C

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 13/20 0.56
ALDH1A1 P00352 1/20 0.50
HTT P42858 1/20 0.49
KDR P35968 1/20 0.48
NPC1 O15118 1/20 0.47
RAB9A P51151 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
SCHEMBL14765095 0.90 HTT (0.52) FGFR1ALDH1A1HTT
SCHEMBL17149327 0.88 FGFR1 (0.51) FGFR1ALDH1A1HTTNPC1RAB9A
SCHEMBL17137292 0.85 HPGD (0.46) FGFR1ALDH1A1HTTKDRNPC1
SCHEMBL3497920 0.84 HTT (0.55) FGFR1HTT
SCHEMBL13028375 0.79 GRM5 (0.42) ALDH1A1HTTNPC1RAB9A
SCHEMBL29520345 0.79 GRM5 (0.42) ALDH1A1HTTNPC1RAB9A
SCHEMBL3040210 0.79 LPL (0.41) FGFR1ALDH1A1NPC1RAB9A
SCHEMBL15205399 0.79 CYP11B1 (0.52) ALDH1A1HTT
SCHEMBL25419693 0.78 MKNK2 (0.40) FGFR1ALDH1A1
SCHEMBL30481337 0.78 MKNK2 (0.40) FGFR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3110803-A1 HETEROAROMATIC DERIVATIVES AND THEIR USE AS PHARMACEUTICALS Mutabilis (FR) 2017-01-04 EP disclosed
US-9365566-B2 Cinnoline derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-06-14 US disclosed
WO-2015128333-A1 HETEROAROMATIC DERIVATIVES AND THEIR USE AS PHARMACEUTICALS LABORATOIRE BIODIM (FR) 2015-09-03 WO disclosed
US-20150038510-A1 CINNOLINE DERIVATIVES TAKEDA CALIFORNIA, INC. 2015-02-05 US disclosed
US-8481733-B2 Substituted imidazopyr- and imidazotri-azines OSI Pharmaceuticals, LLC (US) 2013-07-09 US disclosed
EP-2283020-B1 SUBSTITUTED IMIDAZOPYR-AND IMIDAZOTRI-AZINES OSI PHARM INC (US) 2012-10-31 EP disclosed
EP-2283020-A1 SUBSTITUTED IMIDAZOPYR-AND IMIDAZOTRI-AZINES OSI Pharmaceuticals, Inc. (US) 2011-02-16 EP disclosed
WO-2009143051-A1 SUBSTITUTED IMIDAZOPYR-AND IMIDAZOTRI-AZINES OSI PHARMACEUTICALS, INC. (US) 2009-11-26 WO disclosed
US-20090286768-A1 SUBSTITUTED IMIDAZOPYR- AND IMIDAZOTRI-AZINES OSI PHARMACEUTICALS, INC. (US) 2009-11-19 US disclosed
US-6465484-B1 TYROSINE KINASE INHIBITORS; CANCER, ATHEROSCLEROSIS, DIABETIC RETINOPATHY, AUTOIMMUNE DISEASES, INFLAMMATORY DISEASES MERCK & CO., INC. 2002-10-15 US disclosed
EP-1109555-A4 NOVEL ANGIOGENESIS INHIBITORS MERCK & CO INC (US) 2001-11-21 EP disclosed
EP-1109555-A1 NOVEL ANGIOGENESIS INHIBITORS Merck & Co., Inc. (US) 2001-06-27 EP disclosed
US-6162804-A Tyrosine kinase inhibitors MERCK & CO., INC. (US) 2000-12-19 US disclosed
WO-2000012089-A1 NOVEL ANGIOGENESIS INHIBITORS MERCK & CO., INC. (US) 2000-03-09 WO 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 (2 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-20090286768-A1 SUBSTITUTED IMIDAZOPYR- AND IMIDAZOTRI-AZINES ABL1, TPMT, CYP2C19 FGFR1 163/4885ALDH1A1 292/4885HTT 513/4885
US-20150038510-A1 CINNOLINE DERIVATIVES BTK, LYN, ABL1 FGFR1 1035/4885ALDH1A1 1982/4885HTT 3454/4885

“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.