SCHEMBL31236166

SCHEMBL31236166

CS(=O)(=O)c1ccc2c(c1)sc1nc(-c3ccccc3)cn12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.63
RAB9A P51151 2/20 0.63
SMN1; SMN2 Q16637 2/20 0.63
MAPT P10636 2/20 0.63
LMNA P02545 2/20 0.63
TSHR P16473 1/20 0.63
ATM Q13315 1/20 0.63
TDP1 Q9NUW8 1/20 0.63
NPC1 O15118 1/20 0.53
ALDH1A1 P00352 1/20 0.53
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA9 Q16790 1/20 0.51
THRB P10828 2/20 0.50
RXFP1 Q9HBX9 1/20 0.50
APP P05067 1/20 0.47
SCD O00767 1/20 0.47
POLB P06746 1/20 0.47
PTGS2 P35354 2/20 0.46

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
SCHEMBL24106081 1.00 TP53 (0.63) TP53RAB9ASMN1; SMN2MAPTLMNA
SCHEMBL31338687 0.88 MAPT (0.53) TP53RAB9ASMN1; SMN2MAPTLMNA
SCHEMBL24106018 0.88 CA12 (0.52) TP53RAB9ASMN1; SMN2MAPTLMNA
SCHEMBL31338689 0.87 TP53 (0.65) TP53RAB9ASMN1; SMN2MAPTLMNA
SCHEMBL31338707 0.86 TP53 (0.65) TP53RAB9ASMN1; SMN2MAPTLMNA
SCHEMBL31338693 0.85 LMNA (0.47) TP53RAB9ASMN1; SMN2MAPTLMNA
SCHEMBL31338669 0.85 CA12 (0.46) TP53RAB9ASMN1; SMN2MAPTLMNA
SCHEMBL31338686 0.84 TP53 (0.51) TP53RAB9ASMN1; SMN2MAPTLMNA
SCHEMBL24105970 0.84 CA12 (0.52) TP53RAB9ASMN1; SMN2MAPTLMNA
SCHEMBL31338708 0.83 MAPT (0.67) TP53RAB9ASMN1; SMN2MAPTLMNA

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-2024201962-A1 ENDOPLASMIC RETICULUM STRESS SUPPRESSING COMPOSITION AND LIVER FUNCTION IMPROVING COMPOSITION 日清食品ホールディングス株式会社 2024-10-03 WO disclosed