SCHEMBL29986937

SCHEMBL29986937

O=C(CS(=O)(=O)c1cccc(Cl)n1)N1Cc2ccccc2C1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ POLB P06746 1/20 0.39
▸ NOTUM Q6P988 1/20 0.37
▸ HTT P42858 2/20 0.37
▸ HPGD P15428 1/20 0.36
▸ TAS1R3 Q7RTX0 2/20 0.36
▸ TAS1R1 Q7RTX1 2/20 0.36
▸ TAS1R2 Q8TE23 2/20 0.36
▸ LMNA P02545 3/20 0.36
▸ MAPT P10636 3/20 0.36
▸ TSHR P16473 2/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ TAAR1 Q96RJ0 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36

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
SCHEMBL24814394 1.00 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2POLBNOTUMHTT
SCHEMBL29986725 0.84 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2POLBNOTUMHTT
SCHEMBL29986792 0.84 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2POLBNOTUMHTT
SCHEMBL24815717 0.84 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2POLBNOTUMHTT
SCHEMBL24815895 0.84 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2POLBNOTUMHTT
SCHEMBL24815671 0.80 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2POLBNOTUMHTT
SCHEMBL29986504 0.80 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2POLBNOTUMHTT
SCHEMBL24814458 0.75 TAS1R3 (0.46) ALDH1A1SMN1; SMN2POLBNOTUMHTT
SCHEMBL29986800 0.75 TAS1R3 (0.46) ALDH1A1SMN1; SMN2POLBNOTUMHTT
SCHEMBL24814431 0.75 TAS1R3 (0.43) ALDH1A1SMN1; SMN2POLBHTTHPGD

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
WO-2022251343-A2 CDGSH IRON SULFUR DOMAIN 2 ACTIVATORS AND USE THEREOF NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2022-12-01 — — WO disclosed
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