SCHEMBL20008405

SCHEMBL20008405

Cc1cnc(C)c(C(=C/C=O)/C=C(\N(C)C)N2CCCCC2)c1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 1/20 0.32
PIK3C3 Q8NEB9 2/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL20008409 0.80 PDK1 (0.33)
SCHEMBL20008406 0.68 RAF1 (0.33) HPGD
SCHEMBL20008321 0.67 OPRK1 (0.32) OPRK1PIK3C3
SCHEMBL20008573 0.64
SCHEMBL20008403 0.61 PIK3C3 (0.30) PIK3C3
SCHEMBL20009447 0.60 MAPT (0.33) OPRK1PIK3C3
SCHEMBL24080970 0.59 NOS3 (0.42) OPRK1PIK3C3HPGD
SCHEMBL16913907 0.58 HPGD (0.54) OPRK1PIK3C3HPGD
SCHEMBL20009507 0.58 MAPT (0.33) PIK3C3
SCHEMBL6626587 0.57 SMN1; SMN2 (0.56) OPRK1HPGD

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
EP-3299367-A1 BIARYL AMIDE COMPOUNDS AS KINASE INHIBITORS Novartis AG (CH) 2018-03-28 EP disclosed