SCHEMBL7020161

SCHEMBL7020161

NC(=O)[C@H]1CCCN1C1CCCC1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 9/20 0.40
CNR1 P21554 5/20 0.40
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34
OPRK1 P41145 1/20 0.34
OGFRL1 Q5TC84 1/20 0.34
POLB P06746 1/20 0.33
EPHX1 P07099 1/20 0.33
AR P10275 1/20 0.33
ELANE P08246 2/20 0.32
LMNA P02545 1/20 0.32
KDM4E B2RXH2 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL10979486 0.98 CNR2 (0.41) CNR2CNR1OPRM1OPRD1OPRK1
SCHEMBL7021731 0.98 CNR2 (0.41) CNR2CNR1OPRM1OPRD1OPRK1
Hydrochloric Acid SCHEMBL28111340 0.96 CNR2 (0.40) CNR2CNR1OPRM1OPRD1OPRK1
SCHEMBL15665554 0.94 CNR2 (0.35) CNR2CNR1POLBARELANE
SCHEMBL15665283 0.94 CNR2 (0.35) CNR2CNR1POLBARELANE
SCHEMBL16323018 0.94 CNR2 (0.35) CNR2CNR1POLBARELANE
SCHEMBL31384866 0.88 CNR2 (0.35) CNR2CNR1EPHX1
SCHEMBL29431204 0.85 KDM4E (0.35) CNR2CNR1POLBEPHX1AR
SCHEMBL5721034 0.85 CNR2 (0.46) CNR2CNR1POLB
SCHEMBL5616564 0.85 ALDH1A1 (0.42) CNR2CNR1KDM4E

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-0997474-B1 Antithrombotic agents PFIZER (US) 2003-10-29 EP disclosed
US-6417203-B1 HETEROCYCLIC AMIDES PFIZER INC. 2002-07-09 US disclosed
US-6180627-B1 INDOLE, INDAZOLE, BENZOTRIAZOLE AND BENZIMIDAZOLE DERIVATIVES PFIZER INC. 2001-01-30 US disclosed
EP-0997474-A1 Antithrombotic agents PFIZER INC. (US) 2000-05-03 EP disclosed