SCHEMBL6000596

SCHEMBL6000596

CC(C)(C)C(C[C@H](CCN1CC(N2CCC(F)CC2)C1)c1ccc(Cl)c(Cl)c1)NC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TACR2 P21452 8/20 0.50
MCHR1 Q99705 12/20 0.44

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
SCHEMBL4265276 0.82 TACR2 (0.55) TACR2MCHR1
SCHEMBL6002511 0.81 SLC6A2 (0.35) TACR2
SCHEMBL4265273 0.79 TACR2 (0.68) TACR2
SCHEMBL5016488 0.79 MCHR1 (0.50) TACR2MCHR1
SCHEMBL6000611 0.79 TACR2 (0.56) TACR2
Hydrochloric Acid SCHEMBL4269269 0.78 MCHR1 (0.49) TACR2MCHR1
SCHEMBL5016489 0.77 TACR2 (0.49) TACR2MCHR1
SCHEMBL6000603 0.77 TACR2 (0.60) TACR2
Hydrochloric Acid SCHEMBL4269274 0.76 TACR2 (0.48) TACR2MCHR1
SCHEMBL4265205 0.75 TACR2 (0.55) TACR2MCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1636221-A2 NEW AZETIDINE COMPOUNDS AstraZeneca AB (SE) 2006-03-22 EP disclosed
WO-2004110344-A2 NEW AZETIDINE COMPOUNDS ASTRAZENECA AB (SE) 2004-12-23 WO disclosed