SCHEMBL9059535

SCHEMBL9059535

CSc1nc(C)cc(Cl)c1NC(=O)N(Cc1ccc(Oc2ccc(F)cc2)cc1)C1CCCCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.41
ALDH1A1 P00352 3/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
PPARG P37231 1/20 0.39
PPARD Q03181 1/20 0.39
PPARA Q07869 1/20 0.39
AGER Q15109 2/20 0.39
MTNR1A P48039 1/20 0.39
HTR2A P28223 6/20 0.38
UBE2M P61081 3/20 0.38
DCUN1D1 Q96GG9 3/20 0.38
POLB P06746 1/20 0.38
LMNA P02545 1/20 0.38
ABCB11 O95342 1/20 0.38
CYP1A2 P05177 1/20 0.38
ADRB2 P07550 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM1 P11229 1/20 0.38
DRD1 P21728 1/20 0.38

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
SCHEMBL8807728 0.91 TP53 (0.42) TP53ALDH1A1KMT2AMEN1PPARG
SCHEMBL8809049 0.91 TP53 (0.42) TP53ALDH1A1KMT2AMEN1PPARG
SCHEMBL29972806 0.91 TP53 (0.42) TP53ALDH1A1KMT2AMEN1PPARG
SCHEMBL8808146 0.90 TP53 (0.43) TP53ALDH1A1KMT2AMEN1PPARG
SCHEMBL8817855 0.88 ALDH1A1 (0.44) TP53ALDH1A1KMT2AMEN1PPARG
SCHEMBL8808548 0.87 TP53 (0.41) TP53ALDH1A1KMT2AMEN1PPARG
SCHEMBL9058046 0.86 UBE2M (0.41) ALDH1A1KMT2AMEN1AGERHTR2A
SCHEMBL8807796 0.84 THRB (0.39) TP53ALDH1A1KMT2AMEN1PPARG
SCHEMBL8808860 0.83 USP2 (0.43) TP53ALDH1A1KMT2AUBE2MDCUN1D1
SCHEMBL9057934 0.83 TP53 (0.41) TP53HTR2AUBE2MDCUN1D1ABCB11

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
WO-1996010559-A1 UREA DERIVATIVES AND THEIR USE AS ACAT-INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-04-11 WO disclosed