SCHEMBL2322994

SCHEMBL2322994

CCn1cccc1-c1cc2c(nn1)CCCCC2

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 1/20 0.32
CDK5 Q00535 1/20 0.31
CDK5R1 Q15078 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
RXFP1 Q9HBX9 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
SCHEMBL1382794 0.84 ALOX15 (0.38)
SCHEMBL1383312 0.84 ALOX15 (0.38)
SCHEMBL2328968 0.71 ALDH1A1 (0.45) CDK5CDK5R1
SCHEMBL12826129 0.65 HTR2C (0.40) CDK5CDK5R1NPSR1RXFP1
SCHEMBL1385607 0.65 NPC1 (0.38)
SCHEMBL1383964 0.65 NPC1 (0.38)
SCHEMBL1383142 0.65 NOTUM (0.39) NPSR1
SCHEMBL1383436 0.65 HPGD (0.46)
SCHEMBL1386553 0.65 NOTUM (0.39) NPSR1
SCHEMBL1382864 0.65 CNR2 (0.41)

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-1904455-B1 PYRIDAZINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2011-08-17 EP claimed