SCHEMBL2267128

SCHEMBL2267128

Cc1ccccc2c(C(=O)O)c(C)cc1-2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.51
MCL1 Q07820 1/20 0.50
HPGD P15428 2/20 0.49
MYC P01106 1/20 0.48
CYP3A4 P08684 2/20 0.44
ACHE P22303 1/20 0.44
PLA2G7 Q13093 2/20 0.42
TTR P02766 1/20 0.42
KDM5A P29375 1/20 0.42
KDM4C Q9H3R0 1/20 0.42
KDM5B Q9UGL1 1/20 0.42
KMT2A Q03164 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
CYP2C9 P11712 1/20 0.42
ALDH1A1 P00352 5/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
APAF1 O14727 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL6679648 0.85 MYC (0.55) LDHAMCL1HPGDMYCCYP3A4
SCHEMBL3795573 0.82 L3MBTL1 (0.57) LDHAMCL1HPGDMYCCYP3A4
SCHEMBL10729814 0.82 MCL1 (0.49) LDHAMCL1HPGDMYCCYP3A4
SCHEMBL11492238 0.80 LDHA (0.49) LDHAMCL1HPGDMYCCYP3A4
SCHEMBL1589938 0.80 MYC (0.46) LDHAMCL1HPGDMYCCYP3A4
SCHEMBL29485413 0.78 FOLH1 (0.53) MCL1HPGDMYCCYP3A4KMT2A
SCHEMBL3229734 0.78 FOLH1 (0.53) MCL1HPGDMYCCYP3A4KMT2A
SCHEMBL628517 0.77 MYC (0.51) LDHAMCL1HPGDMYCCYP3A4
Bicarbonate SCHEMBL8972762 0.77 MYC (0.54) LDHAMCL1HPGDMYCACHE
SCHEMBL8959286 0.76 CA12 (0.59) LDHAMCL1HPGDMYCCYP3A4

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
EP-2521765-A1 NATURAL SHADING AGENTS Unilever PLC (GB) 2012-11-14 EP claimed
WO-2011082889-A1 NATURAL SHADING AGENTS UNILEVER PLC (GB) 2011-07-14 WO claimed
EP-2521765-A1 NATURAL SHADING AGENTS Unilever PLC (GB) 2012-11-14 EP disclosed
WO-2011082889-A1 NATURAL SHADING AGENTS UNILEVER PLC (GB) 2011-07-14 WO disclosed