SCHEMBL10696484

SCHEMBL10696484

CC(Cl)C(=O)Nc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.62
HPGD P15428 3/20 0.61
RNF4 P78317 1/20 0.58
MTNR1B P49286 1/20 0.57
MAPK1 P28482 1/20 0.57
PGR P06401 1/20 0.57
NPY5R Q15761 7/20 0.56
NPC1 O15118 1/20 0.55
CRHBP P24387 1/20 0.55
RAB9A P51151 1/20 0.55
CRHR2 Q13324 1/20 0.55
ALDH1A1 P00352 1/20 0.55
ALOX12 P18054 1/20 0.55
HTT P42858 1/20 0.55
XIAP P98170 1/20 0.55
TGM2 P21980 1/20 0.54
EPHX1 P07099 1/20 0.54
NPY2R P49146 1/20 0.53

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
SCHEMBL10315613 0.87 MTNR1B (0.73) SMN1; SMN2HPGDRNF4MTNR1BMAPK1
SCHEMBL2516508 0.84 ALDH1A1 (0.67) SMN1; SMN2HPGDNPC1RAB9AALDH1A1
SCHEMBL5662256 0.84 SMN1; SMN2 (0.62) SMN1; SMN2HPGDRNF4MTNR1BMAPK1
SCHEMBL5662258 0.84 SMN1; SMN2 (0.62) SMN1; SMN2HPGDRNF4MTNR1BMAPK1
SCHEMBL11642853 0.84 XIAP (0.70) SMN1; SMN2HPGDRNF4MTNR1BMAPK1
Water SCHEMBL27691964 0.83 ALDH1A1 (0.65) SMN1; SMN2HPGDNPC1RAB9AALDH1A1
SCHEMBL3683038 0.82 MAPT (0.53) SMN1; SMN2HPGDNPC1RAB9AALDH1A1
SCHEMBL11760683 0.81 SMN1; SMN2 (0.67) SMN1; SMN2HPGDMTNR1BMAPK1PGR
SCHEMBL12329947 0.81 NPY5R (0.64) SMN1; SMN2HPGDRNF4MTNR1BMAPK1
SCHEMBL2610080 0.80 KMT2A (0.65) SMN1; SMN2HPGDNPY5RCRHBPCRHR2

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-0255178-A2 Process for preparing hetero aryl and aryl alkanoic acids Nobel Chemicals AB (SE) 1988-02-03 EP disclosed