SCHEMBL8566696

SCHEMBL8566696

O=C1CCC(OC2CCCCO2)(c2ccc(Cl)c(Cl)c2)CN1Cc1ccc(F)cc1

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 20/20 0.52
TACR2 P21452 1/20 0.40

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
SCHEMBL8567221 0.91 TACR1 (0.51) TACR1TACR2
SCHEMBL8569702 0.90 TACR1 (0.48) TACR1TACR2
SCHEMBL8970672 0.81 TACR1 (0.47) TACR1TACR2
SCHEMBL8558529 0.78 TACR1 (0.48) TACR1TACR2
SCHEMBL8300796 0.75 TACR1 (0.59) TACR1TACR2
SCHEMBL7817874 0.74 TACR1 (0.54) TACR1
SCHEMBL8564503 0.74 SLC6A3 (0.37) TACR1
SCHEMBL8563068 0.74 TACR1 (0.47) TACR1TACR2
SCHEMBL7846541 0.74 TACR1 (0.60) TACR1TACR2
SCHEMBL8559009 0.73 TACR1 (0.53) TACR1TACR2

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
US-5726313-A Substituted arylaliphatic compounds, method of preparing them and pharmaceutical compositions in which they are present SANOFI (FR) 1998-03-10 US disclosed
EP-0700386-A1 NEUROKININ RECEPTOR ANTAGONISTS SANOFI (FR) 1996-03-13 EP disclosed
WO-1995026338-A1 NEUROKININ RECEPTOR ANTAGONISTS SANOFI (FR) 1995-10-05 WO disclosed