SCHEMBL11094339

SCHEMBL11094339

O=C(/C=C\C(=O)ON1CCC2(CC1)CN(c1ccccc1Cl)c1ccccc12)ON1CCC2(CC1)CN(c1ccccc1Cl)c1ccccc12

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 3/20 0.40
P2RY1 P47900 14/20 0.39
NOTUM Q6P988 2/20 0.39
OPRM1 P35372 1/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
P2RX1 P51575 1/20 0.36

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
SCHEMBL11095657 0.82 SLC18A3 (0.43) NPY5RP2RY1NOTUMOPRM1OPRD1
SCHEMBL11094372 0.80 PDE4B (0.37)
Maleic Acid SCHEMBL11083525 0.79 P2RY1 (0.47) NPY5RP2RY1NOTUM
Fumaric Acid SCHEMBL11083528 0.79 P2RY1 (0.47) NPY5RP2RY1NOTUM
SCHEMBL11093049 0.77 L3MBTL1 (0.42)
SCHEMBL11091981 0.76 AKT1 (0.51) NPY5RP2RY1NOTUM
Fumaric Acid SCHEMBL11094343 0.75 AKT1 (0.48) NPY5RP2RY1NOTUM
Maleic Acid SCHEMBL11094337 0.75 AKT1 (0.48) NPY5RP2RY1NOTUM
SCHEMBL11095431 0.73 AKT1 (0.38) NPY5RP2RY1NOTUM
Maleic Acid SCHEMBL11096220 0.70 MAPT (0.44) NPY5RP2RY1NOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4477667-A Spiro[indoline-3,4'-piperidine]s and related compounds AMERICAN HOECHST CORPORATION (US) 1984-10-16 US disclosed
US-4408050-A Spiro(indoline-3,4'-piperidine) and related compounds AMERICAN HOECHST CORPORATION (US) 1983-10-04 US disclosed
US-4379932-A Process for preparing spiro[indoline-3,4'-piperidine]s AMERICAN HOECHST CORPORATION (US) 1983-04-12 US disclosed
US-4345081-A Spiro[indoline-3,4'-piperidine]s AMERICAN HOECHST CORPORATION (US) 1982-08-17 US disclosed
US-4307235-A Spiro[indoline-3,4'-piperidine]s AMERICAN HOECHST CORPORATION (US) 1981-12-22 US disclosed