SCHEMBL28307456

SCHEMBL28307456

COc1ccc(CN2C=C(c3cc(C(F)F)nc(S(C)(=O)=O)n3)C=CC2)cc1OC

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SDHB P21912 6/20 0.43
▸ LMNA P02545 5/20 0.41
▸ KMT2A Q03164 5/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ KDM4E B2RXH2 4/20 0.41
▸ SMN1; SMN2 Q16637 4/20 0.38
▸ TP53 P04637 3/20 0.38
▸ HPGD P15428 2/20 0.38
▸ HTT P42858 2/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ MAPT P10636 1/20 0.37
▸ PDE2A O00408 1/20 0.36
▸ PDE3A Q14432 1/20 0.36
▸ SIGMAR1 Q99720 1/20 0.33
▸ MITF O75030 1/20 0.32
▸ STAT3 P40763 1/20 0.32
▸ MAPK1 P28482 2/20 0.32
▸ MEN1 O00255 2/20 0.32

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
SCHEMBL28307460 0.88 SDHB (0.45) SDHBLMNAKMT2AALDH1A1KDM4E
SCHEMBL30526106 0.86 SDHB (0.59) SDHBLMNAKMT2AALDH1A1KDM4E
SCHEMBL28307462 0.86 SDHB (0.59) SDHBLMNAKMT2AALDH1A1KDM4E
SCHEMBL28307435 0.85 SDHB (0.33) SDHBLMNAKMT2AALDH1A1KDM4E
SCHEMBL28306291 0.83 SDHB (0.41) SDHBLMNAKMT2AALDH1A1KDM4E
SCHEMBL28307450 0.83 SDHB (0.39) SDHBLMNAKMT2AKDM4ESMN1; SMN2
SCHEMBL28306340 0.82 TP53 (0.37) LMNAKMT2AALDH1A1SMN1; SMN2TP53
SCHEMBL28306356 0.82 SDHB (0.35) SDHBLMNAKMT2ATP53HPGD
SCHEMBL30526108 0.80 SDHB (0.40) SDHBLMNAKMT2ASMN1; SMN2TP53
SCHEMBL28306297 0.80 ACHE (0.39) SDHBKMT2AALDH1A1SMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110023292-A Apoptosis inhibitor 北京生命科学研究所 2019-07-16 — — CN disclosed
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