SCHEMBL28306451

SCHEMBL28306451

CCOc1cccc(CN2C=C(c3cc(C(F)(F)F)nc(S(C)(=O)=O)n3)C=CC2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SDHB P21912 16/20 0.61
▸ HPGD P15428 5/20 0.41
▸ NPSR1 Q6W5P4 5/20 0.41
▸ TP53 P04637 4/20 0.41
▸ HTT P42858 4/20 0.41
▸ STAT3 P40763 3/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ HSD17B10 Q99714 3/20 0.41
▸ LMNA P02545 3/20 0.41
▸ S1PR4 O95977 2/20 0.41
▸ S1PR1 P21453 2/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ STAT1 P42224 1/20 0.41
▸ TLR9 Q9NR96 1/20 0.41
▸ KDM4E B2RXH2 4/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ SMN1; SMN2 Q16637 3/20 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
SCHEMBL28306448 0.91 SDHB (0.60) SDHBHPGDNPSR1TP53HTT
SCHEMBL28307441 0.86 SDHB (0.56) SDHBHPGDNPSR1TP53HTT
SCHEMBL28307433 0.86 SDHB (0.59) SDHBHPGDNPSR1TP53HTT
SCHEMBL28307458 0.86 SDHB (0.46) SDHBHPGDNPSR1TP53HTT
SCHEMBL28875024 0.86 SDHB (0.59) SDHBHPGDNPSR1TP53HTT
SCHEMBL28306295 0.85 SDHB (0.47) SDHBHPGDNPSR1TP53HTT
SCHEMBL28306358 0.84 SDHB (0.61) SDHBHPGDNPSR1TP53HTT
SCHEMBL22912246 0.83 SDHB (0.43) SDHBHPGDNPSR1TP53HTT
SCHEMBL28306261 0.83 SDHB (0.58) SDHBHPGDNPSR1TP53HTT
SCHEMBL28306389 0.82 SDHB (0.49) SDHBHPGDNPSR1TP53HTT

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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