SCHEMBL6654151

SCHEMBL6654151

C=CCN1CCN([C@@H](c2ccc(-c3nnnn3CC(=O)O)cc2)c2cccc(O)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 14/20 0.51
P2RX7 Q99572 1/20 0.48
TSHR P16473 1/20 0.47
OPRM1 P35372 1/20 0.45
OPRK1 P41145 1/20 0.45

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
SCHEMBL6654146 1.00 OPRD1 (0.51) OPRD1P2RX7TSHROPRM1OPRK1
SCHEMBL6654141 1.00 OPRD1 (0.51) OPRD1P2RX7TSHROPRM1OPRK1
SCHEMBL6653593 0.90 P2RX7 (0.54) OPRD1P2RX7TSHROPRM1OPRK1
SCHEMBL6653601 0.90 P2RX7 (0.54) OPRD1P2RX7TSHROPRM1OPRK1
SCHEMBL6653585 0.90 P2RX7 (0.54) OPRD1P2RX7TSHROPRM1OPRK1
SCHEMBL6656914 0.89 P2RX7 (0.55) OPRD1P2RX7TSHROPRM1OPRK1
SCHEMBL6656899 0.89 P2RX7 (0.55) OPRD1P2RX7TSHROPRM1OPRK1
SCHEMBL6656907 0.89 P2RX7 (0.55) OPRD1P2RX7TSHROPRM1OPRK1
SCHEMBL6652596 0.87 OPRD1 (0.57) OPRD1P2RX7OPRM1OPRK1
SCHEMBL6652601 0.87 OPRD1 (0.57) OPRD1P2RX7OPRM1OPRK1

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-0983251-B1 ANTI-INFLAMMATORY PIPERAZINYL-BENZYL-TETRAZOLE DERIVATIVES AND INTERMEDIATES THEREOF PFIZER LTD (GB) 2004-06-23 EP disclosed
US-6514975-B1 Tetrazoles as selective agonists for the delta opioid receptor PFIZER INC 2003-02-04 US disclosed