SCHEMBL361801

SCHEMBL361801

NC(=O)c1ccc(Sc2ncnc3cc4c(cc23)OCCOCCOCCO4)c(F)c1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EGFR P00533 14/20 0.42
TSHR P16473 1/20 0.41
BRAF P15056 1/20 0.41
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
RAB9A P51151 1/20 0.40
KIT P10721 1/20 0.37
PDE5A O76074 1/20 0.36
PI4K2A Q9BTU6 1/20 0.35
GAK O14976 1/20 0.35
RIPK2 O43353 1/20 0.35
BUB1 O43683 1/20 0.35
STK10 O94804 1/20 0.35
CARS1 P49589 1/20 0.35
MAP3K1 Q13233 1/20 0.35
PIP4K2C Q8TBX8 1/20 0.35
SLK Q9H2G2 1/20 0.35

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
SCHEMBL14937573 0.85 TSHR (0.42) EGFRTSHRNPC1ALDH1A1RAB9A
SCHEMBL361802 0.84 EGFR (0.47) EGFRBRAFKITGAKRIPK2
SCHEMBL14937611 0.79 EGFR (0.57) EGFRGAKRIPK2BUB1STK10
SCHEMBL12503386 0.78 MET (0.48) EGFRTSHRBRAFNPC1ALDH1A1
SCHEMBL12503365 0.73 MET (0.46) EGFRTSHRBRAFKITRIPK2
SCHEMBL14937427 0.73 TSHR (0.42) EGFRTSHRBRAFNPC1RAB9A
SCHEMBL10133801 0.71 MET (0.46) EGFRBRAFKIT
SCHEMBL18040358 0.70 MET (0.48) EGFRBRAFALDH1A1KIT
SCHEMBL14966643 0.69 MET (0.47) TSHRKIT
SCHEMBL362781 0.68 PLK4 (0.42) EGFRGAKRIPK2BUB1STK10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2593462-B1 NOVEL FUSED HETEROCYCLIC DERIVATIVES USEFUL AS C-MET TYROSINE KINASE INHIBITORS BETTA PHARMACEUTICALS CO LTD (CN) 2016-09-07 EP claimed
US-9242991-B2 Substituted fused heterocycles as c-Met tyrosine kinase inhibitors BETTA PHARMACEUTICALS CO., LTD (CN) 2016-01-26 US claimed
US-20130123286-A1 Novel Fused Heterocyclic Derivatives Useful as c-Met Tyrosine Kinase Inhibitors BETTA PHARMACEUTICALS CO., LTD. (CN) 2013-05-16 US claimed
US-9242991-B2 Substituted fused heterocycles as c-Met tyrosine kinase inhibitors BETTA PHARMACEUTICALS CO., LTD (CN) 2016-01-26 US disclosed
EP-2593462-A1 NOVEL FUSED HETEROCYCLIC DERIVATIVES USEFUL AS c-MET TYROSINE KINASE INHIBITORS Zhejiang Beta Pharma Inc. (CN) 2013-05-22 EP disclosed
US-20130123286-A1 Novel Fused Heterocyclic Derivatives Useful as c-Met Tyrosine Kinase Inhibitors BETTA PHARMACEUTICALS CO., LTD. (CN) 2013-05-16 US disclosed
WO-2012006960-A1 NOVEL FUSED HETEROCYCLIC DERIVATIVES USEFUL AS c-MET TYROSINE KINASE INHIBITORS ZHEJIANG BETA PHARMA INC. (CN) 2012-01-19 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-20130123286-A1 Novel Fused Heterocyclic Derivatives Useful as c-Met Tyrosine Kinase Inhibitors MET, RET, ABL1 EGFR 30/4885TSHR 2399/4885BRAF 16/4885

“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.