SCHEMBL27830697

SCHEMBL27830697

CCc1sc(C(=O)O)nc1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.34
ALDH1A1 P00352 4/20 0.33
MAPT P10636 1/20 0.33
HCAR2 Q8TDS4 1/20 0.32
CDC7 O00311 1/20 0.31
DBF4 Q9UBU7 1/20 0.31
GABRP O00591 1/20 0.31
GABRD O14764 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB1 P18505 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
GABRA2 P47869 1/20 0.31
GABRB2 P47870 1/20 0.31
GABRA4 P48169 1/20 0.31
GABRE P78334 1/20 0.31
GABRA6 Q16445 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
SCHEMBL290148 0.82 ALDH1A1 (0.37) TRPM8L3MBTL1ALDH1A1MAPTHCAR2
SCHEMBL1560369 0.80 TRPM8 (0.42) TRPM8ALDH1A1MAPTCDC7DBF4
SCHEMBL17760500 0.79 L3MBTL1 (0.35) L3MBTL1ALDH1A1HCAR2GABRPGABRD
SCHEMBL7406267 0.77 GABRP (0.34) L3MBTL1ALDH1A1MAPTGABRPGABRD
SCHEMBL2483879 0.73 ALDH1A1 (0.59) L3MBTL1ALDH1A1MAPTHPGDTSHR
SCHEMBL20284164 0.71
SCHEMBL1531797 0.71 L3MBTL1 (0.38) L3MBTL1ALDH1A1HCAR2
SCHEMBL17760514 0.70 RORC (0.32)
SCHEMBL30036393 0.69 ALDH1A1 (0.37) TRPM8ALDH1A1MAPTHCAR2CDC7
SCHEMBL19516698 0.69 RORC (0.34) L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105461589-A Acylamino-substituted fused cyclopentanecarboxylic acid derivatives and their use as pharmaceuticals SANOFI AVENTIS 2016-04-06 CN disclosed
CN-105418450-A ACYLAMINO-SUBSTITUTED FUSED CYCLOPENTANECARBOXYLIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS SANOFI AVENTIS 2016-03-23 CN disclosed
CN-102083432-B Acylamino-substituted fused cyclopentanecarboxylic acid derivatives and their use as pharmaceuticals SANOFI-AVENTIS (FR) 2016-02-17 CN disclosed
CN-102083432-A Acylamino-substituted fused cyclopentanecarboxylic acid derivatives and their use as pharmaceuticals SANOFI AVENTIS 2011-06-01 CN disclosed