SCHEMBL28307450

SCHEMBL28307450

COc1ccc(CN2C=C(c3cc(C(F)F)nc(S(=O)(=O)CCCOCc4ccccc4)n3)C=CC2)cc1OC

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SDHB P21912 8/20 0.39
▸ NPC1 O15118 3/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ PDE2A O00408 1/20 0.32
▸ PDE3A Q14432 1/20 0.32
▸ KMT2A Q03164 3/20 0.32
▸ LMNA P02545 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ NPSR1 Q6W5P4 2/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ STAT3 P40763 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ MAPK1 P28482 1/20 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
SCHEMBL28306356 0.87 SDHB (0.35) SDHBNPC1RAB9APDE2APDE3A
SCHEMBL28307456 0.83 SDHB (0.43) SDHBPDE2APDE3AKMT2ALMNA
SCHEMBL20985660 0.80 SDHB (0.63) SDHB
SCHEMBL28307435 0.78 SDHB (0.33) SDHBPDE2APDE3AKMT2ALMNA
SCHEMBL28306419 0.78 SDHB (0.46) SDHBKMT2ALMNAHPGDNPSR1
SCHEMBL28307434 0.75 SDHB (0.63) SDHBKMT2ALMNAHPGDNPSR1
SCHEMBL28306456 0.75 SDHB (0.64) SDHBKMT2ALMNAHPGDNPSR1
SCHEMBL28306444 0.75 SDHB (0.54) SDHBKMT2ALMNAHPGDNPSR1
SCHEMBL28910510 0.74 TP53 (0.39) SDHBKMT2ALMNAHPGDKDM4E
SCHEMBL28306340 0.73 TP53 (0.37) PDE2APDE3AKMT2ALMNATP53

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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