SCHEMBL29976224

SCHEMBL29976224

[O-][S+](CCc1ccccc1)c1nc(-c2cccs2)cc(C(F)(F)F)n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SDHB P21912 4/20 0.59
▸ KDM4E B2RXH2 10/20 0.48
▸ ADORA2A P29274 1/20 0.48
▸ ALDH1A1 P00352 7/20 0.47
▸ HPGD P15428 6/20 0.47
▸ HSD17B10 Q99714 4/20 0.47
▸ MAPK1 P28482 3/20 0.47
▸ HTT P42858 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ S1PR4 O95977 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ TP53 P04637 1/20 0.47
▸ S1PR1 P21453 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ TLR8 Q9NR97 1/20 0.46
▸ TSHR P16473 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL19805862 1.00 SDHB (0.59) SDHBKDM4EADORA2AALDH1A1HPGD
SCHEMBL19805905 0.90 SDHB (0.54) SDHBKDM4EADORA2AALDH1A1HPGD
SCHEMBL29976249 0.90 SDHB (0.54) SDHBKDM4EADORA2AALDH1A1HPGD
SCHEMBL19805829 0.88 SDHB (0.56) SDHBKDM4EADORA2AALDH1A1HPGD
SCHEMBL29976478 0.88 SDHB (0.56) SDHBKDM4EADORA2AALDH1A1HPGD
SCHEMBL19806052 0.84 HPGD (0.60) SDHBKDM4EADORA2AALDH1A1HPGD
SCHEMBL29976621 0.84 SDHB (0.59) SDHBKDM4EADORA2AALDH1A1HPGD
SCHEMBL19805635 0.84 SDHB (0.59) SDHBKDM4EADORA2AALDH1A1HPGD
SCHEMBL19805730 0.83 SDHB (0.58) SDHBKDM4EADORA2AALDH1A1HPGD
SCHEMBL29976137 0.83 SDHB (0.58) SDHBKDM4EADORA2AALDH1A1HPGD

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-B Apoptosis inhibitors 北京生命科学研究所 2022-10-04 — — CN disclosed
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