SCHEMBL1507657

SCHEMBL1507657

C#Cc1cccc(N)c1CC=C

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 1/20 0.37
GABRA1 P14867 1/20 0.31
GABRB2 P47870 1/20 0.31
NR4A2 P43354 1/20 0.31
PTPN1 P18031 1/20 0.30
PTPN6 P29350 1/20 0.30
PTPN11 Q06124 1/20 0.30

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
SCHEMBL3261826 0.82 IMPDH2 (0.37) IMPDH2GABRA1GABRB2
SCHEMBL10709835 0.80 IMPDH2 (0.46) IMPDH2GABRA1GABRB2
SCHEMBL1372930 0.76 CYP3A4 (0.36) GABRA1
SCHEMBL1570705 0.73 GABRA1 (0.47) IMPDH2GABRA1GABRB2
SCHEMBL9280552 0.72 IMPDH2 (0.40) IMPDH2GABRA1GABRB2
SCHEMBL21987780 0.72 IMPDH2 (0.40) IMPDH2GABRA1GABRB2
SCHEMBL11388669 0.72 IMPDH2 (0.40) IMPDH2GABRA1GABRB2
Hydrochloric Acid SCHEMBL4050779 0.72 GABRA1 (0.46) IMPDH2GABRA1GABRB2
SCHEMBL89099 0.72 TSHR (0.43) IMPDH2GABRA1GABRB2
SCHEMBL11665572 0.72 IMPDH2 (0.40) IMPDH2GABRA1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3103799-A1 QUINAZOLINE DERIVATIVES OSI Pharmaceuticals, LLC (US) 2016-12-14 EP disclosed
US-20160303127-A1 COMBINATION THERAPY WITH C-MET AND EGFR ANTAGONISTS GENENTECH INC (US) 2016-10-20 US disclosed
EP-2163546-B1 Quinazoline derivatives PFIZER PROD INC (US) 2016-06-01 EP disclosed
US-20150086545-A1 COMBINATION THERAPY OF HER EXPRESSING TUMORS GENENTECH, INC. (US) 2015-03-26 US disclosed
US-20150056207-A1 COMBINATION THERAPY WITH C-MET AND EGFR ANTAGONISTS GENENTECH INC (US) 2015-02-26 US disclosed
EP-1853300-B1 METHODS OF USING DEATH RECEPTOR AGONISTS AND EGFR INHIBITORS GENENTECH INC (US) 2014-07-23 EP disclosed
US-20120251530-A1 COMBINATION THERAPY OF HER EXPRESSING TUMORS SLIWKOWSKI MARK X (US) 2012-10-04 US disclosed
US-20120189573-A1 Methods of using death receptor agonists and EGFR inhibitors GENENTECH, INC. (US) 2012-07-26 US disclosed
US-8163287-B2 Combination therapy of her expressing tumors GENENTECH, INC. (US) 2012-04-24 US disclosed
US-20110262436-A1 TREATMENT METHOD GENENTECH, INC. (US) 2011-10-27 US disclosed
WO-2007013950-A9 COMBINATION THERAPY OF HER EXPRESSING TUMORS GENENTECH INC (US) 2007-03-29 WO disclosed
WO-2007013950-A2 COMBINATION THERAPY OF HER EXPRESSING TUMORS GENENTECH, INC. (US) 2007-02-01 WO disclosed
US-20070020261-A1 Combination therapy of her expressing tumors GENENTECH, INC. 2007-01-25 US disclosed
WO-2006089015-A2 METHODS OF USING DEATH RECEPTOR AGONISTS AND EGFR INHIBITORS GENENTECH, INC. (US) 2006-08-24 WO disclosed
US-20060188498-A1 Methods of using death receptor agonists and EGFR inhibitors GENENTECH, INC. 2006-08-24 US disclosed
EP-0817775-B1 QUINAZOLINE DERIVATIVES PFIZER (US) 2001-09-12 EP disclosed
EP-1110953-A1 Quinazoline derivatives PFIZER INC. (US) 2001-06-27 EP disclosed
US-5747498-A Alkynyl and azido-substituted 4-anilinoquinazolines PFIZER INC. (US) 1998-05-05 US disclosed
EP-0817775-A1 QUINAZOLINE DERIVATIVES PFIZER INC. (US) 1998-01-14 EP disclosed
WO-1996030347-A1 QUINAZOLINE DERIVATIVES PFIZER INC. (US) 1996-10-03 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 (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-20120189573-A1 Methods of using death receptor agonists and EGFR inhibitors EGFR, ERBB4, TNFRSF9 IMPDH2 2697/4885GABRA1 3756/4885GABRB2 3773/4885
US-20150086545-A1 COMBINATION THERAPY OF HER EXPRESSING TUMORS ERBB2, EGFR, ERBB3 IMPDH2 3679/4885GABRA1 2772/4885GABRB2 2526/4885
US-20060188498-A1 Methods of using death receptor agonists and EGFR inhibitors EGFR, ERBB4, TNFRSF9 IMPDH2 2697/4885GABRA1 3756/4885GABRB2 3773/4885
US-20070020261-A1 Combination therapy of her expressing tumors ERBB2, EGFR, ERBB3 IMPDH2 3679/4885GABRA1 2772/4885GABRB2 2526/4885
US-20160303127-A1 COMBINATION THERAPY WITH C-MET AND EGFR ANTAGONISTS MET, EGFR, ERBB2 IMPDH2 3756/4885GABRA1 1684/4885GABRB2 1944/4885
US-20110262436-A1 TREATMENT METHOD HGF, HDGF, FGF2 IMPDH2 2299/4885GABRA1 3764/4885GABRB2 2962/4885
US-20150056207-A1 COMBINATION THERAPY WITH C-MET AND EGFR ANTAGONISTS MET, EGFR, ERBB2 IMPDH2 3756/4885GABRA1 1684/4885GABRB2 1944/4885
US-20120251530-A1 COMBINATION THERAPY OF HER EXPRESSING TUMORS ERBB2, EGFR, ERBB3 IMPDH2 3679/4885GABRA1 2772/4885GABRB2 2526/4885

“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.