SCHEMBL4582369

SCHEMBL4582369

COc1ccc2cccc(C(CN)CNC(C)=O)c2c1

nearest known ligand 0.81

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 20/20 0.81
MTNR1B P49286 16/20 0.81
HTR2C P28335 7/20 0.81
HTR2B P41595 1/20 0.56
NQO2 P16083 1/20 0.48

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
Hydrochloric Acid SCHEMBL5128659 0.99 MTNR1A (0.79) MTNR1AMTNR1BHTR2CHTR2BNQO2
SCHEMBL4583464 0.93 MTNR1A (0.88) MTNR1AMTNR1BHTR2CHTR2BNQO2
SCHEMBL3328651 0.90 MTNR1A (0.79) MTNR1AMTNR1BHTR2CHTR2BNQO2
SCHEMBL3328976 0.89 MTNR1A (1.00) MTNR1AMTNR1BHTR2CHTR2BNQO2
SCHEMBL3326557 0.88 MTNR1A (0.81) MTNR1AMTNR1BHTR2CHTR2BNQO2
SCHEMBL4582729 0.88 MTNR1A (0.81) MTNR1AMTNR1BHTR2CHTR2BNQO2
SCHEMBL4582982 0.88 MTNR1A (0.81) MTNR1AMTNR1BHTR2CHTR2BNQO2
Hydrochloric Acid SCHEMBL5125205 0.88 MTNR1A (0.80) MTNR1AMTNR1BHTR2C
SCHEMBL4583437 0.87 MTNR1A (0.83) MTNR1AMTNR1BHTR2CHTR2BNQO2
SCHEMBL5120175 0.87 MTNR1A (0.79) MTNR1AMTNR1BHTR2CHTR2BNQO2

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-1900723-A1 New naphthalene derivatives, method of preparing same and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2008-03-19 EP disclosed