SCHEMBL16667011

SCHEMBL16667011

CCSc1ccccc1-c1ncc2ccc(C(F)(F)F)cc2n1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALOX5AP P20292 1/20 0.38
▸ FEN1 P39748 1/20 0.38
▸ USP1 O94782 2/20 0.37
▸ WDR48 Q8TAF3 2/20 0.37
▸ DDR1 Q08345 4/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ MET P08581 1/20 0.35
▸ BCHE P06276 1/20 0.34
▸ PDE10A Q9Y233 3/20 0.33
▸ ATR Q13535 1/20 0.33
▸ SLC6A2 P23975 1/20 0.33
▸ SLC6A4 P31645 1/20 0.33
▸ SLC6A3 Q01959 1/20 0.33
▸ METAP2 P50579 1/20 0.33
▸ MAPK14 Q16539 1/20 0.33
▸ PTGDR2 Q9Y5Y4 1/20 0.33
▸ PDE2A O00408 1/20 0.33

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
SCHEMBL16872713 0.86 NPC1 (0.39) ALOX5APFEN1USP1WDR48DDR1
SCHEMBL16885086 0.84 NPC1 (0.40) ALOX5APFEN1NPC1ATMBCHE
SCHEMBL16872716 0.80 DDR1 (0.38) ALOX5APFEN1USP1WDR48DDR1
SCHEMBL16872722 0.79 CTSD (0.38) DDR1NPC1ATMPDE10AATR
SCHEMBL16872712 0.79 DDR1 (0.37) ALOX5APFEN1USP1WDR48DDR1
SCHEMBL16872729 0.79 DDR1 (0.37) ALOX5APFEN1USP1WDR48DDR1
SCHEMBL16666222 0.79 ALOX5AP (0.47) ALOX5APFEN1DDR1NPC1ATM
SCHEMBL16666266 0.78 DDR1 (0.44) ALOX5APFEN1USP1WDR48DDR1
SCHEMBL16666416 0.77 ALOX5AP (0.36) ALOX5APFEN1NPC1ATMMET
SCHEMBL19525390 0.76 ALOX5AP (0.36) ALOX5APFEN1USP1WDR48NPC1

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-2865671-B1 FUSED HETEROCYCLIC COMPOUND SUMITOMO CHEMICAL CO (JP) 2017-11-01 — — EP disclosed
US-9328121-B1 Fused heterocyclic compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-05-03 — — US disclosed
US-9328121-B1 Fused heterocyclic compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-05-03 — — US disclosed
US-20160102100-A1 FUSED HETEROCYCLIC COMPOUND SUMITOMO CHEMICAL CO (JP) 2016-04-14 — — US disclosed
US-20160102100-A1 FUSED HETEROCYCLIC COMPOUND SUMITOMO CHEMICAL CO (JP) 2016-04-14 — — US disclosed
US-9260436-B2 Fused heterocyclic compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-02-16 — — US disclosed
US-9260436-B2 Fused heterocyclic compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-02-16 — — US disclosed
US-20150191474-A1 FUSED HETEROCYCLIC COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-07-09 — — US disclosed
US-20150191474-A1 FUSED HETEROCYCLIC COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-07-09 — — US disclosed
EP-2865671-A1 FUSED HETEROCYCLIC COMPOUND SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2015-04-29 — — EP 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-20160102100-A1 FUSED HETEROCYCLIC COMPOUND NR4A1, CYP4B1, NR1H4 ALOX5AP 1753/4885FEN1 3562/4885USP1 2651/4885
US-20150191474-A1 FUSED HETEROCYCLIC COMPOUND NR4A1, NR0B1, NR0B2 ALOX5AP 2352/4885FEN1 3267/4885USP1 2314/4885

“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.

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