SCHEMBL8669574

SCHEMBL8669574

CCCCN(CC(F)(F)F)C(=O)C1c2cc(F)ccc2-c2ccc(F)c(N3CCC(NC(=O)OC(C)(C)C)C3)c21

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM4D Q6B0I6 4/20 0.36
▸ RET P07949 1/20 0.35
▸ NTRK1 P04629 3/20 0.35
▸ DPP4 P27487 1/20 0.34
▸ SYK P43405 1/20 0.34
▸ NPY5R Q15761 3/20 0.34
▸ TRPV1 Q8NER1 2/20 0.33
▸ CKS1B P61024 1/20 0.33
▸ SKP1 P63208 1/20 0.33
▸ SKP2 Q13309 1/20 0.33
▸ BRD4 O60885 1/20 0.33
▸ BTK Q06187 1/20 0.33
▸ SUV39H2 Q9H5I1 1/20 0.33

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
SCHEMBL8484139 0.96 NTRK1 (0.36) KDM4DRETNTRK1NPY5RCKS1B
SCHEMBL8504386 0.94 NTRK1 (0.34) KDM4DRETNTRK1DPP4
SCHEMBL8665212 0.88 CCR3 (0.39) RET
SCHEMBL8666005 0.84 NPY5R (0.36) KDM4DRETSYKNPY5RTRPV1
SCHEMBL8500943 0.81 CCR3 (0.36) RET
SCHEMBL8482320 0.81 NPY5R (0.37) KDM4DRETNTRK1NPY5RCKS1B
SCHEMBL8503043 0.79 NPY5R (0.33) KDM4DRETNTRK1DPP4NPY5R
SCHEMBL8504363 0.77 KCNA5 (0.30) —
SCHEMBL8479385 0.76 DPP4 (0.38) DPP4NPY5R
SCHEMBL8664869 0.73 SMPD3 (0.38) CKS1BSKP1SKP2

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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