SCHEMBL8808573

SCHEMBL8808573

CSc1cc(C)nc(SC)c1NC(=O)N(Cc1ccc(Oc2ccccc2F)cc1)C1CCCCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 11/20 0.41
LPAR5 Q9H1C0 11/20 0.41
USP2 O75604 3/20 0.40
ALDH1A1 P00352 3/20 0.40
LMNA P02545 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
PPARG P37231 1/20 0.38
PPARD Q03181 1/20 0.38
PPARA Q07869 1/20 0.38
TP53 P04637 1/20 0.37
KDM4E B2RXH2 2/20 0.37
HPGD P15428 1/20 0.37
CASP1 P29466 1/20 0.37
CASP7 P55210 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL29972806 0.91 TP53 (0.42) USP2ALDH1A1LMNANPSR1PPARG
SCHEMBL8807728 0.91 TP53 (0.42) USP2ALDH1A1LMNANPSR1PPARG
SCHEMBL8809049 0.91 TP53 (0.42) USP2ALDH1A1LMNANPSR1PPARG
SCHEMBL8808860 0.90 USP2 (0.43) USP2ALDH1A1LMNANPSR1TP53
SCHEMBL9056629 0.86 KMT2A (0.38) USP2ALDH1A1LMNANPSR1TP53
SCHEMBL9058046 0.86 UBE2M (0.41) USP2ALDH1A1LMNANPSR1KDM4E
SCHEMBL8807796 0.86 THRB (0.39) USP2ALDH1A1LMNANPSR1PPARG
SCHEMBL8344843 0.85 KDM4E (0.42) USP2ALDH1A1TP53KDM4EHPGD
SCHEMBL8338160 0.85 SLC6A2 (0.44) USP2ALDH1A1LMNANPSR1KDM4E
SCHEMBL8810429 0.85 LPAR1 (0.44) LPAR1LPAR5USP2ALDH1A1LMNA

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-0784612-A1 UREA DERIVATIVES AND THEIR USE AS ACAT-INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-07-23 EP disclosed