SCHEMBL6656907

SCHEMBL6656907

C=CCN1CCN([C@H](c2ccc(-c3nnnn3CCCCC(=O)O)cc2)c2cccc(O)c2)CC1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 2/20 0.55
OPRD1 P41143 13/20 0.47
TSHR P16473 1/20 0.46
OPRM1 P35372 1/20 0.42
OPRK1 P41145 1/20 0.42

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
SCHEMBL6656914 1.00 P2RX7 (0.55) P2RX7OPRD1TSHROPRM1OPRK1
SCHEMBL6656899 1.00 P2RX7 (0.55) P2RX7OPRD1TSHROPRM1OPRK1
SCHEMBL6653593 0.98 P2RX7 (0.54) P2RX7OPRD1TSHROPRM1OPRK1
SCHEMBL6653601 0.98 P2RX7 (0.54) P2RX7OPRD1TSHROPRM1OPRK1
SCHEMBL6653585 0.98 P2RX7 (0.54) P2RX7OPRD1TSHROPRM1OPRK1
SCHEMBL6654141 0.89 OPRD1 (0.51) P2RX7OPRD1TSHROPRM1OPRK1
SCHEMBL6654151 0.89 OPRD1 (0.51) P2RX7OPRD1TSHROPRM1OPRK1
SCHEMBL6654146 0.89 OPRD1 (0.51) P2RX7OPRD1TSHROPRM1OPRK1
Hydrochloric Acid SCHEMBL6657016 0.89 OPRD1 (0.54) P2RX7OPRD1TSHROPRM1OPRK1
Hydrochloric Acid SCHEMBL6657006 0.89 OPRD1 (0.54) P2RX7OPRD1TSHROPRM1OPRK1

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