SCHEMBL5612955

SCHEMBL5612955

C=CCOc1nc2c(cc1I)C(C)CCNC2

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 1/20 0.34

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
SCHEMBL2079778 0.81 HTR2C (0.43) CHRM3
SCHEMBL5593821 0.81 HTR2A (0.38)
SCHEMBL5612907 0.73
SCHEMBL5604265 0.73 HTR2C (0.31)
SCHEMBL5613036 0.69 HTR2A (0.34)
SCHEMBL5612854 0.69 HTR2C (0.38)
SCHEMBL2080257 0.67 ABHD6 (0.31)
SCHEMBL5613118 0.67 TXNRD1 (0.33)
SCHEMBL1095359 0.63 HTR2C (0.66)
SCHEMBL1095158 0.63 HTR2C (0.66)

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-2007140213-A1 PYRIDOAZEPINE DERIVATIVES FOREST LABORATORIES HOLDINGS LIMITED (BM) 2007-12-06 WO claimed