SCHEMBL6373544

SCHEMBL6373544

CCSc1ccc2cccc(CCNC(=O)C(F)(F)F)c2c1

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 14/20 0.65
MTNR1B P49286 8/20 0.65
NQO2 P16083 4/20 0.58
HTR2C P28335 1/20 0.46
HTR2B P41595 1/20 0.46
TRPV1 Q8NER1 1/20 0.46

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
SCHEMBL6076132 0.88 MTNR1A (0.74) MTNR1AMTNR1BNQO2HTR2CHTR2B
SCHEMBL6075887 0.86 MTNR1A (0.77) MTNR1AMTNR1BNQO2HTR2CHTR2B
SCHEMBL27544425 0.82 MTNR1A (0.69) MTNR1AMTNR1BNQO2HTR2CHTR2B
SCHEMBL5343899 0.81 MTNR1A (0.70) MTNR1AMTNR1BNQO2HTR2CHTR2B
SCHEMBL7830444 0.80 MTNR1A (0.62) MTNR1AMTNR1BNQO2
SCHEMBL6076561 0.79 MTNR1A (0.74) MTNR1AMTNR1BNQO2HTR2CHTR2B
SCHEMBL8858530 0.79 MTNR1A (0.67) MTNR1AMTNR1BNQO2TRPV1
SCHEMBL6075773 0.77 MTNR1A (0.65) MTNR1AMTNR1BNQO2HTR2CHTR2B
SCHEMBL6076556 0.77 MTNR1A (0.74) MTNR1AMTNR1BNQO2HTR2CHTR2B
Acetamide SCHEMBL7838095 0.74 MTNR1A (0.69) MTNR1AMTNR1BNQO2HTR2CHTR2B

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-6872851-B1 Substituted cyclic compounds, preparation method and pharmaceutical compositions containing them LES LABORATORIES SERVIER (FR) 2005-03-29 US disclosed