SCHEMBL7817528

SCHEMBL7817528

COc1ccc(C(=O)N2CC=C(c3cccc(OC(C)(C)C(=O)OC(C)C)c3)CC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.49
POLB P06746 1/20 0.45
ALOX15 P16050 1/20 0.45
TDP1 Q9NUW8 2/20 0.41
CDK4 P11802 1/20 0.40
CCND1 P24385 1/20 0.40
HPGD P15428 3/20 0.40
PPARG P37231 3/20 0.40
PPARA Q07869 3/20 0.40
DRD3 P35462 2/20 0.40
USP2 O75604 2/20 0.40
LMNA P02545 2/20 0.40
CYP1A2 P05177 2/20 0.40
TSHR P16473 2/20 0.40
MAPK1 P28482 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 1/20 0.40
ABCB11 O95342 1/20 0.40
CYP3A4 P08684 1/20 0.40
ADORA3 P0DMS8 1/20 0.40

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
SCHEMBL7804444 0.93 NAMPT (0.44) NAMPTPOLBALOX15TDP1HPGD
SCHEMBL7813905 0.92 ALDH1A1 (0.46) NAMPTPOLBALOX15TDP1HPGD
SCHEMBL7814015 0.91 NAMPT (0.44) NAMPTPOLBALOX15TDP1HPGD
SCHEMBL7809885 0.91 POLB (0.41) NAMPTPOLBALOX15TDP1HPGD
SCHEMBL7811486 0.91 PPARG (0.49) NAMPTPOLBALOX15TDP1HPGD
SCHEMBL7817469 0.90 NAMPT (0.44) NAMPTPOLBALOX15TDP1HPGD
SCHEMBL7813624 0.90 POLB (0.40) NAMPTPOLBALOX15TDP1HPGD
SCHEMBL7817414 0.88 NAMPT (0.52) NAMPTPOLBALOX15TDP1CDK4
SCHEMBL7804294 0.87 HPGD (0.39) NAMPTPOLBALOX15TDP1HPGD
SCHEMBL7813597 0.86 HPGD (0.39) NAMPTPOLBALOX15TDP1HPGD

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-0607536-B1 Arylamide derivatives SS PHARMACEUTICAL CO (JP) 2001-01-24 EP disclosed
US-5532371-A SIDE EFFECT REDUCTION SS PHARMACEUTICAL CO., LTD. (JP) 1996-07-02 US disclosed
US-5411972-A Arylamide derivatives for treating hyperlipemia SS PHARMACEUTICAL CO., LTD. (JP) 1995-05-02 US disclosed
EP-0607536-A1 Arylamide derivatives SS PHARMACEUTICAL CO., LTD. (JP) 1994-07-27 EP disclosed