SCHEMBL8666557

SCHEMBL8666557

CCCCN(CC(F)(F)F)C(=O)C1c2ccccc2-c2cccc(N3CCCC3NC(=O)Nc3ccccc3)c21

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CCKBR P32239 6/20 0.34
▸ EPHX2 P34913 3/20 0.33
▸ UBE2M P61081 4/20 0.33
▸ DCUN1D1 Q96GG9 4/20 0.33
▸ HPGD P15428 1/20 0.33
▸ EGFR P00533 1/20 0.33
▸ KMT2A Q03164 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ CCR3 P51677 1/20 0.32
▸ DRD2 P14416 1/20 0.32
▸ DRD4 P21917 1/20 0.32
▸ DRD3 P35462 1/20 0.32

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
SCHEMBL8676079 0.98 CCKBR (0.35) CCKBREPHX2UBE2MDCUN1D1ALDH1A1
SCHEMBL8663540 0.84 BRD4 (0.31) KMT2ADRD2DRD3
SCHEMBL8655308 0.83 KCNQ3 (0.32) —
SCHEMBL8648884 0.83 — —
SCHEMBL8655154 0.83 HCRTR2 (0.33) —
SCHEMBL8482395 0.83 MAPT (0.38) KMT2AALDH1A1MEN1CCR3DRD2
SCHEMBL8650737 0.82 POLB (0.32) ALDH1A1
SCHEMBL8479118 0.82 OPRK1 (0.32) KMT2ADRD2DRD3
SCHEMBL8655139 0.82 F10 (0.32) —
SCHEMBL8652603 0.81 USP30 (0.34) —

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
US-5827875-A PYRROLIDINE DERIVATIVES; ANTIATHEROSCLEROSIS AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 1998-10-27 — — US disclosed
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