SCHEMBL18828282

SCHEMBL18828282

CNc1scc(CC(N)=O)c1CO

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL14980674 0.79 MAPK8 (0.32) ALDH1A1RAB9AL3MBTL1
SCHEMBL14980641 0.76 MEN1 (0.31) ALDH1A1RAB9AL3MBTL1
SCHEMBL13174918 0.65 ALDH1A1 (0.38) ALDH1A1
SCHEMBL14585671 0.60 ADRA2A (0.36) ALDH1A1RAB9A
SCHEMBL3743443 0.60 KDM4E (0.43) ALDH1A1L3MBTL1
SCHEMBL4788947 0.60 ALOX5 (0.38) ALDH1A1
Ammonia Solution, Strong SCHEMBL28139473 0.59 KDM4E (0.42) ALDH1A1L3MBTL1
SCHEMBL28866716 0.58 L3MBTL1 (0.44) L3MBTL1
SCHEMBL21259103 0.58 MEN1 (0.61) ALDH1A1
SCHEMBL11210003 0.58 FABP4 (0.38) ALDH1A1

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
EP-2858999-B1 AMIDES OF 2-AMINO-4-ARYLTHIAZOLE COMPOUNDS AND THEIR SALTS GLENMARK PHARMACEUTICALS SA (CH) 2017-05-10 — — EP disclosed
Send feedback