SCHEMBL16593940

SCHEMBL16593940

CCSc1ccsc1-c1nc2cc(C(F)(F)F)cnc2n1C

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.48
▸ CASP3 P42574 1/20 0.33
▸ KDM4E B2RXH2 4/20 0.32
▸ ALDH1A1 P00352 4/20 0.32
▸ GAA P10253 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ KMT2A Q03164 3/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ PPARG P37231 1/20 0.32
▸ NCOA2 Q15596 1/20 0.32
▸ NCOA1 Q15788 1/20 0.32
▸ NCOA3 Q9Y6Q9 1/20 0.32
▸ HPGD P15428 2/20 0.31
▸ DDR1 Q08345 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ PTGS2 P35354 1/20 0.31
▸ MET P08581 3/20 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
SCHEMBL16604821 0.85 CYP2A6 (0.33) POLBKDM4ESMN1; SMN2
SCHEMBL16609060 0.85 POLB (0.34) POLB
SCHEMBL16609141 0.84 POLB (0.48) POLBKDM4EALDH1A1KMT2AMEN1
SCHEMBL16593840 0.83 POLB (0.48) POLBKDM4EMET
SCHEMBL29431598 0.81 POLB (0.52) POLBCASP3KDM4EALDH1A1L3MBTL1
SCHEMBL14677239 0.81 POLB (0.52) POLBCASP3KDM4EALDH1A1L3MBTL1
SCHEMBL16593676 0.81 POLB (0.42) POLBCASP3KDM4EALDH1A1GAA
SCHEMBL16594408 0.81 CASP3 (0.46) POLBCASP3KDM4EALDH1A1GAA
SCHEMBL16593966 0.81 POLB (0.45) POLBKDM4EALDH1A1GAAL3MBTL1
SCHEMBL15411967 0.81 POLB (0.49) POLBKDM4EALDH1A1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2857396-B1 FUSED HETEROCYCLIC COMPOUNDS FOR PEST CONTROL SUMITOMO CHEMICAL CO (JP) 2018-11-21 — — EP disclosed
US-9120792-B2 Fused heterocyclic compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-09-01 — — US disclosed
US-9120792-B2 Fused heterocyclic compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-09-01 — — US disclosed
EP-2857396-A1 FUSED HETEROCYCLIC COMPOUND Sumitomo Chemical Co., Ltd (JP) 2015-04-08 — — EP disclosed
US-20150094329-A1 FUSED HETEROCYCLIC COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-04-02 — — US disclosed
US-20150094329-A1 FUSED HETEROCYCLIC COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-04-02 — — US 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-20150094329-A1 FUSED HETEROCYCLIC COMPOUND CYC1, H1-0, H1-3 POLB 4498/4885CASP3 256/4885KDM4E 3132/4885

“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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