SCHEMBL8812974

SCHEMBL8812974

Cc1cc(C)c(NC(=O)N(Cc2cccc(-c3nnnn3C)c2)C2CCCCCC2)c(C)c1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 9/20 0.43
UBE2M P61081 2/20 0.42
DCUN1D1 Q96GG9 2/20 0.42
GAA P10253 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TP53 P04637 4/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
CASR P41180 1/20 0.40
POLB P06746 1/20 0.40
ROCK2 O75116 1/20 0.39
NTRK1 P04629 1/20 0.39

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
SCHEMBL8813280 0.85 GAA (0.41) UBE2MDCUN1D1GAANPSR1TP53
SCHEMBL8807120 0.84 GAA (0.48) UBE2MDCUN1D1GAANPSR1TP53
SCHEMBL9057529 0.83 WNT1 (0.44) UBE2MDCUN1D1GAANPSR1TP53
SCHEMBL8807169 0.82 ROCK2 (0.42) UBE2MDCUN1D1GAANPSR1TP53
SCHEMBL9056291 0.80 ROCK2 (0.43) UBE2MDCUN1D1GAANPSR1TP53
SCHEMBL8809549 0.80 GAA (0.44) UBE2MDCUN1D1GAANPSR1TP53
SCHEMBL8809258 0.80 ROCK2 (0.57) GAANPSR1THRBROCK2NTRK1
SCHEMBL8809317 0.80 ROCK2 (0.43) UBE2MDCUN1D1GAANPSR1TP53
SCHEMBL9059369 0.79 GAA (0.49) UBE2MDCUN1D1GAANPSR1TP53
SCHEMBL9056992 0.79 LMNA (0.45) GAANPSR1MAPTROCK2NTRK1

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