SCHEMBL94198

SCHEMBL94198

CCOC=CC(=O)Nc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 5/20 0.54
MMP1 P03956 5/20 0.53
MMP2 P08253 5/20 0.53
MMP9 P14780 5/20 0.53
MAOB P27338 3/20 0.53
MAOA P21397 1/20 0.53
ALDH1A1 P00352 4/20 0.52
MAPT P10636 4/20 0.52
LMNA P02545 1/20 0.52
THRB P10828 1/20 0.52
TGM2 P21980 1/20 0.49
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
STAT1 P42224 1/20 0.47
KDM4E B2RXH2 2/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 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
SCHEMBL12455934 1.00 EGFR (0.54) EGFRMMP1MMP2MMP9MAOB
SCHEMBL19501010 0.94 EGFR (0.52) EGFRMMP1MMP2MMP9MAOB
SCHEMBL19501547 0.90 LPAR1 (0.51) EGFRMMP1MMP2MMP9MAOB
SCHEMBL19501828 0.87 KMT2A (0.49) EGFRALDH1A1MAPTLMNANPC1
SCHEMBL15708022 0.85 NMT1 (0.58) EGFRMMP1MMP2MMP9ALDH1A1
SCHEMBL15708023 0.85 NMT1 (0.58) EGFRMMP1MMP2MMP9ALDH1A1
SCHEMBL9294171 0.84 CREBBP (0.55) ALDH1A1LMNANPC1RAB9AMEN1
SCHEMBL9294166 0.84 CREBBP (0.55) ALDH1A1LMNANPC1RAB9AMEN1
SCHEMBL24970900 0.84 KMT2A (0.56) EGFRMMP1MMP2MMP9ALDH1A1
SCHEMBL3973117 0.84 RAB9A (0.53) EGFRALDH1A1MAPTLMNATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2923703-B1 TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS NANTBIO INC (US) 2018-09-19 EP disclosed
EP-2923703-A1 TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS Abraxis BioScience, Inc. (US) 2015-09-30 EP disclosed
EP-2425840-B1 Triazine derivatives and their therapeutical applications ABRAXIS BIOSCIENCE INC (US) 2015-04-08 EP disclosed
US-8580786-B2 Triazine derivatives and their therapeutical applications NANT HOLDINGS IP, LLC (US) 2013-11-12 US disclosed
EP-2425840-A1 Triazine derivatives and their therapeutical applications Abraxis BioScience, Inc. (US) 2012-03-07 EP disclosed
US-20110150763-A1 TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS ABRAXIS BIOSCIENCE, LLC (US) 2011-06-23 US disclosed
US-7858782-B2 Triazine derivatives and their therapeutical applications ABRAXIS BIOSCIENCE, LLC (US) 2010-12-28 US disclosed
EP-2120964-A2 TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS Abraxis BioScience, Inc. (US) 2009-11-25 EP disclosed
US-20080176853-A1 e.g. N-(2-chloro-6-methylphenyl)-3-ethoxyacrylamide; protein (tyrosine and serine/threonine) kinase inhibitor; variety of conditions and diseases; antiproliferative, anticarcinogenic, antiinflammatory, antiallergenic agent; autoimmune and neurodegenerative disorders ABRAXIS BIOSCIENCE, INC. (US) 2008-07-24 US disclosed
WO-2008076883-A2 TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS ABRAXIS BIOSCIENCE, INC. (US) 2008-06-26 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-20110150763-A1 TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS BAZ2A, CAMKK2, BAZ1A EGFR 1767/4885MMP1 2030/4885MMP2 1923/4885
US-20080176853-A1 e.g. N-(2-chloro-6-methylphenyl)-3-ethoxyacrylamide; protein (tyrosine and serine/threonine) kinase inhibitor; variety of conditions and diseases; antiproliferative, anticarcinogenic, antiinflammatory, antiallergenic agent; autoimmune and neurodegenerative disorders MAP3K15, DSTYK, STK25 EGFR 687/4885MMP1 1952/4885MMP2 2342/4885

“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.