SCHEMBL8715089

SCHEMBL8715089

CCCC(=O)NCCc1cn(C(C)CC)c2c(Cl)cc(OCC)cc12

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 12/20 0.48
MTNR1B P49286 11/20 0.48
SMN1; SMN2 Q16637 1/20 0.40
POLB P06746 1/20 0.38

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
SCHEMBL8718574 0.69 MTNR1A (0.42) MTNR1AMTNR1BSMN1; SMN2
SCHEMBL7055579 0.68 MTNR1A (0.48) MTNR1AMTNR1BPOLB
SCHEMBL8717471 0.64 CNR2 (0.40) MTNR1AMTNR1B
SCHEMBL17949536 0.64 MTNR1A (0.69) MTNR1AMTNR1B
SCHEMBL8711852 0.64 MTNR1A (0.50) MTNR1AMTNR1BSMN1; SMN2
SCHEMBL8136431 0.63 MTNR1A (0.78) MTNR1AMTNR1B
SCHEMBL7893165 0.62 SMN1; SMN2 (0.52) MTNR1AMTNR1BSMN1; SMN2
SCHEMBL8712203 0.62 MTNR1A (0.61) MTNR1AMTNR1BPOLB
SCHEMBL7056605 0.61 MTNR1A (0.37) MTNR1AMTNR1B
SCHEMBL8717757 0.61 MTNR1A (0.45) MTNR1AMTNR1B

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
US-5770610-A ADMINISTERING R-(+)-N-(2-METHYL-2-(5-METHOXY-6-CHLOROINDOL-3-YL)ETHYL) ACETAMIDE ELI LILLY AND COMPANY (US) 1998-06-23 US disclosed