SCHEMBL7563350

SCHEMBL7563350

O=C1CC[C@](CC2OCCO2)(c2ccc(Cl)c(Cl)c2)CN1CC1CCC(F)(F)CC1

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TACR2 P21452 10/20 0.63
TACR1 P25103 11/20 0.54

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
SCHEMBL7563358 1.00 TACR2 (0.63) TACR2TACR1
SCHEMBL7564297 0.84 TACR2 (0.58) TACR2TACR1
SCHEMBL7564301 0.84 TACR2 (0.58) TACR2TACR1
SCHEMBL7560046 0.80 TACR2 (0.60) TACR2TACR1
SCHEMBL7560035 0.80 TACR2 (0.60) TACR2TACR1
SCHEMBL7811978 0.80 TACR2 (0.62) TACR2TACR1
SCHEMBL6984664 0.77 TACR1 (0.61) TACR2TACR1
SCHEMBL3083325 0.76 TACR2 (1.00) TACR2TACR1
SCHEMBL3083322 0.76 TACR2 (1.00) TACR2TACR1
SCHEMBL5901167 0.72 TACR1 (0.40) TACR2TACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0888337-B1 PIPERIDONE TACHYKININ ANTAGONISTS PFIZER RES & DEV (IE) 2002-06-05 EP disclosed
CN-1072666-C (Azetidin-1-ylalkyl) lactams as tachykinin antagonists PFIZER RES AND DEV CO N V S A (IE) 2001-10-10 CN disclosed
US-6262075-B1 Piperidone tachykinin antagonists PFIZER INC 2001-07-17 US disclosed
CN-1154699-A (Azetidin-1-ylalkyl) lactams as tachykinin antagonists PFIZER LTD (IE) 1997-07-16 CN disclosed