SCHEMBL15575436

SCHEMBL15575436

Cc1cc(I)c(F)cc1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.46
TSHR P16473 2/20 0.46
MAPK1 P28482 1/20 0.46
ALDH1A1 P00352 5/20 0.43
CYP1A2 P05177 1/20 0.43
ALOX15 P16050 1/20 0.43
CASP7 P55210 1/20 0.43
HIF1A Q16665 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TERT O14746 1/20 0.37
TDP1 Q9NUW8 3/20 0.36
CASP1 P29466 1/20 0.36
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
UHRF1 Q96T88 1/20 0.33
ATAD2 Q6PL18 1/20 0.33
S100B P04271 1/20 0.32
CA1 P00915 1/20 0.31

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
SCHEMBL26512765 0.91 CYP3A4 (0.46) CYP3A4TSHRMAPK1ALDH1A1CYP1A2
SCHEMBL404671 0.81 CYP3A4 (0.35) CYP3A4TSHRMAPK1ALDH1A1TDP1
SCHEMBL966908 0.79 CYP3A4 (0.55) CYP3A4TSHRMAPK1ALDH1A1CYP1A2
SCHEMBL17298240 0.79 CYP3A4 (0.55) CYP3A4TSHRMAPK1ALDH1A1CYP1A2
SCHEMBL29502024 0.79 CYP3A4 (0.55) CYP3A4TSHRMAPK1ALDH1A1CYP1A2
SCHEMBL19884912 0.79 PTK2 (0.39) ALDH1A1CA1CA2CA3CA9
SCHEMBL3871506 0.79 ACHE (0.33) HTR2AHTR2CHTR2B
SCHEMBL30391007 0.79 PTK2 (0.39) ALDH1A1CA1CA2CA3CA9
SCHEMBL832391 0.77 CYP3A4 (0.60) CYP3A4TSHRMAPK1ALDH1A1CYP1A2
SCHEMBL219912 0.77 ALDH1A1 (0.40) ALDH1A1CA1CA2CA3CA9

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
EP-2892904-B1 HIGHLY SELECTIVE C-MET INHIBITORS AS ANTICANCER AGENTS CB THERAPEUTICS INC (KY) 2018-10-17 EP disclosed
EP-3345907-A1 NOVEL PYRAZOLO[3,4-d]PYRIMIDINE COMPOUND OR SALT THEREOF Taiho Pharmaceutical Co., Ltd. (JP) 2018-07-11 EP disclosed
US-9695175-B2 Highly selective c-Met inhibitors as anticancer agents CB THERAPEUTICS INC. (KY) 2017-07-04 US disclosed
US-9695175-B2 Highly selective c-Met inhibitors as anticancer agents CB THERAPEUTICS INC. (KY) 2017-07-04 US disclosed
US-9695175-B2 Highly selective c-Met inhibitors as anticancer agents CB THERAPEUTICS INC. (KY) 2017-07-04 US disclosed
US-20150218171-A1 HIGHLY SELECTIVE C-MET INHIBITORS AS ANTICANCER AGENTS APOLLOMICS INC. 2015-08-06 US disclosed
US-20150218171-A1 HIGHLY SELECTIVE C-MET INHIBITORS AS ANTICANCER AGENTS APOLLOMICS INC. 2015-08-06 US disclosed
US-20150218171-A1 HIGHLY SELECTIVE C-MET INHIBITORS AS ANTICANCER AGENTS APOLLOMICS INC. 2015-08-06 US disclosed
EP-2892904-A1 HIGHLY SELECTIVE C-MET INHIBITORS AS ANTICANCER AGENTS Crown Bioscience Inc. (Taiwan) (CN) 2015-07-15 EP disclosed
WO-2014032498-A1 HIGHLY SELECTIVE C-MET INHIBITORS AS ANTICANCER AGENTS CROWN BIOSCIENCE INC. (TAICANG) (CN) 2014-03-06 WO disclosed
WO-2014032498-A1 HIGHLY SELECTIVE C-MET INHIBITORS AS ANTICANCER AGENTS CROWN BIOSCIENCE INC. (TAICANG) (CN) 2014-03-06 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 (1 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-20150218171-A1 HIGHLY SELECTIVE C-MET INHIBITORS AS ANTICANCER AGENTS MET, MYC, HGFAC CYP3A4 4350/4885TSHR 1944/4885MAPK1 223/4885

“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.