SCHEMBL7540141

SCHEMBL7540141

N#CC1Cc2cc(Cl)c(Cl)cc21

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TRPM5 Q9NZQ8 1/20 0.37
HTR2A P28223 3/20 0.34
HTR2C P28335 3/20 0.34
HTR2B P41595 3/20 0.34
CHRNB2 P17787 1/20 0.32
CHRNA4 P43681 1/20 0.32

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
SCHEMBL7543257 0.81 HTR2C (0.46) HTR2AHTR2CHTR2B
SCHEMBL10850914 0.76 HTR2C (0.45) TRPM5HTR2AHTR2CHTR2BCHRNB2
SCHEMBL3028639 0.76 TRPM5 (0.41) TRPM5HTR2AHTR2CHTR2BCHRNB2
SCHEMBL10292643 0.75 FYN (0.40)
SCHEMBL6985110 0.72 MEN1 (0.35)
SCHEMBL2501307 0.72 CHRNB2 (0.42) HTR2ACHRNB2CHRNA4
SCHEMBL6981317 0.71 HTR1A (0.50)
SCHEMBL13428611 0.71 CYP3A4 (0.43)
SCHEMBL333286 0.71 CYP3A4 (0.43)
SCHEMBL7431595 0.71 CYP3A4 (0.43)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0940386-B1 Benzocyclobutan compounds, their process for preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2002-05-22 EP disclosed
US-6107345-A ANTIDEPRESSANT; PSYCHOLOGICAL DISORDERS ADIR ET COMPAGNIE (FR) 2000-08-22 US disclosed
EP-0940386-A1 Benzocyclobutan compounds, their process for preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1999-09-08 EP disclosed