SCHEMBL28307462

SCHEMBL28307462

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

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SDHB P21912 14/20 0.59
▸ NPSR1 Q6W5P4 6/20 0.56
▸ HPGD P15428 5/20 0.56
▸ HTT P42858 4/20 0.56
▸ LMNA P02545 4/20 0.56
▸ TP53 P04637 4/20 0.56
▸ SMN1; SMN2 Q16637 4/20 0.56
▸ KMT2A Q03164 3/20 0.56
▸ HSD17B10 Q99714 3/20 0.56
▸ KDM4E B2RXH2 4/20 0.48
▸ STAT3 P40763 4/20 0.48
▸ MITF O75030 2/20 0.48
▸ ALDH1A1 P00352 3/20 0.45
▸ USP2 O75604 1/20 0.45
▸ RAB9A P51151 3/20 0.41
▸ STAT1 P42224 2/20 0.41
▸ TLR9 Q9NR96 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ S1PR4 O95977 1/20 0.41
▸ POLB P06746 1/20 0.41

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
SCHEMBL30526106 1.00 SDHB (0.59) SDHBNPSR1HPGDHTTLMNA
SCHEMBL28307452 0.90 SDHB (0.48) SDHBNPSR1HPGDHTTLMNA
SCHEMBL28306261 0.89 SDHB (0.58) SDHBNPSR1HPGDHTTLMNA
SCHEMBL28307460 0.88 SDHB (0.45) SDHBNPSR1HPGDHTTLMNA
SCHEMBL28307434 0.88 SDHB (0.63) SDHBNPSR1HPGDHTTLMNA
SCHEMBL28306444 0.87 SDHB (0.54) SDHBNPSR1HPGDHTTLMNA
SCHEMBL28306456 0.87 SDHB (0.64) SDHBNPSR1HPGDHTTLMNA
SCHEMBL28306448 0.87 SDHB (0.60) SDHBNPSR1HPGDHTTLMNA
SCHEMBL28307457 0.86 SDHB (0.56) SDHBNPSR1HPGDHTTLMNA
SCHEMBL28307456 0.86 SDHB (0.43) SDHBNPSR1HPGDHTTLMNA

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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