SCHEMBL7473336

SCHEMBL7473336

Cc1scc(OC(=O)O)c1N

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.32
DAO P14920 2/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
NCEH1 Q6PIU2 1/20 0.30

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
SCHEMBL6152982 0.81 MAPT (0.40) MAPTMEN1ALDH1A1KMT2ANCEH1
Hydrochloric Acid SCHEMBL6610508 0.79 MAPT (0.39) MAPTMEN1NPC1ALDH1A1RAB9A
SCHEMBL6612802 0.78 ALDH1A1 (0.41) MAPTMEN1NPC1ALDH1A1RAB9A
SCHEMBL6610237 0.77 MAPT (0.35) MAPTALDH1A1RAB9AKMT2A
SCHEMBL10715629 0.74
SCHEMBL3212809 0.71 KDM4E (0.44) MAPTDAOMEN1ALDH1A1KMT2A
SCHEMBL9025506 0.69 KMT2A (0.36) MAPTMEN1ALDH1A1RAB9AKMT2A
SCHEMBL1551324 0.67 CA12 (0.41) MAPTMEN1ALDH1A1KMT2A
SCHEMBL4707547 0.67 TDP1 (0.31)
SCHEMBL1617947 0.67 MAPT (0.45) MAPTMEN1ALDH1A1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1200426-A1 SUBSTITUTED THIENE-3-YL-SULFONYL AMINO(THIO)CARBONYL-TRIAZOLIN(THI)ONES Bayer Aktiengesellschaft (DE) 2002-05-02 EP disclosed
WO-2001005788-A1 SUBSTITUTED THIENE-3-YL-SULFONYL AMINO(THIO)CARBONYL-TRIAZOLIN(THI)ONES BAYER AKTIENGESELLSCHAFT (DE) 2001-01-25 WO disclosed