SCHEMBL21342013

SCHEMBL21342013

COc1ccc(C2CN(Cc3ccncc3)C(=O)C[C@H]2NC(=O)Nc2ccc(F)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 12/20 0.59
FPR1 P21462 15/20 0.57
CCR3 P51677 1/20 0.47

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
SCHEMBL21342492 0.90 FPR1 (0.71) FPR2FPR1CCR3
SCHEMBL21342569 0.86 FPR1 (0.71) FPR2FPR1CCR3
SCHEMBL21342493 0.86 FPR1 (0.71) FPR2FPR1CCR3
SCHEMBL21342015 0.81 KDM1A (0.44) FPR2FPR1
SCHEMBL21333912 0.79 FPR2 (0.60) FPR2FPR1CCR3
SCHEMBL21331928 0.79 FPR2 (0.60) FPR2FPR1CCR3
SCHEMBL21341999 0.78 FPR1 (0.64) FPR2FPR1
SCHEMBL21332006 0.78 FPR1 (0.64) FPR2FPR1
SCHEMBL21331992 0.77 FPR1 (0.73) FPR2FPR1
SCHEMBL21342328 0.77 FPR1 (0.73) FPR2FPR1

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-2019170904-A1 PIPERIDINES OR PIPERIDONES SUBSTITUTED WITH UREA AND PHENYL Grünenthal GmbH (DE) 2019-09-12 WO disclosed