SCHEMBL7804677

SCHEMBL7804677

O=C1CCC(CCN2CC(N3CCOCC3)C2)(c2ccc(Cl)c(Cl)c2)CN1CC1CCCCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 14/20 1.00
TACR2 P21452 7/20 1.00

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
SCHEMBL7462043 0.89 TACR2 (1.00) TACR1TACR2
SCHEMBL7813792 0.88 TACR1 (0.94) TACR1TACR2
SCHEMBL8861327 0.87 TACR1 (0.77) TACR1TACR2
SCHEMBL3083325 0.86 TACR2 (1.00) TACR1TACR2
SCHEMBL3083322 0.86 TACR2 (1.00) TACR1TACR2
SCHEMBL7817312 0.86 TACR1 (0.94) TACR1TACR2
SCHEMBL31061161 0.85 TACR1 (1.00) TACR1TACR2
SCHEMBL3094798 0.85 TACR1 (1.00) TACR1TACR2
SCHEMBL3094790 0.85 TACR1 (1.00) TACR1TACR2
SCHEMBL7814154 0.84 TACR1 (1.00) 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
EP-0775132-B1 (AZETIDIN-1-YLALKYL)LACTAMS AS TACHYKININ ANTAGONISTS PFIZER LTD (GB) 2001-03-28 EP disclosed
US-5968923-A ANTIINFLAMMATORY AGENTS, TREATMENT OF NERVOUS SYSTEM DISORDERS, GASTROINTESTINAL DISORDERS PFIZER INC. (US) 1999-10-19 US disclosed
WO-1996005193-A1 (AZETIDIN-1-YLALKYL)LACTAMS AS TACHYKININ ANTAGONISTS PFIZER LIMITED (GB) 1996-02-22 WO disclosed