SCHEMBL11095657

SCHEMBL11095657

O=C(/C=C\C(=O)ON1CCC2(CC1)CN(c1ccc(F)cc1)c1ccccc12)ON1CCC2(CC1)CN(c1ccc(F)cc1)c1ccccc12

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 2/20 0.43
SIGMAR1 Q99720 1/20 0.43
NPY5R Q15761 1/20 0.38
P2RY1 P47900 13/20 0.38
FFAR1 O14842 1/20 0.38
NOTUM Q6P988 2/20 0.37
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
OPRK1 P41145 1/20 0.35
P2RX1 P51575 1/20 0.35

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
SCHEMBL11094339 0.82 NPY5R (0.40) NPY5RP2RY1NOTUMOPRM1OPRD1
SCHEMBL11085101 0.77 AKT1 (0.49) SLC18A3SIGMAR1NPY5RP2RY1NOTUM
Fumaric Acid SCHEMBL11095659 0.76 P2RY1 (0.45) SLC18A3SIGMAR1NPY5RP2RY1NOTUM
Maleic Acid SCHEMBL11095653 0.76 P2RY1 (0.45) SLC18A3SIGMAR1NPY5RP2RY1NOTUM
SCHEMBL11138166 0.76 SLC18A3 (0.41) SLC18A3SIGMAR1NPY5RP2RY1FFAR1
SCHEMBL11138170 0.76 SLC18A3 (0.41) SLC18A3SIGMAR1NPY5RP2RY1FFAR1
Bromide SCHEMBL11090547 0.76 AKT1 (0.48) SLC18A3SIGMAR1NPY5RP2RY1NOTUM
SCHEMBL11094372 0.76 PDE4B (0.37)
SCHEMBL11093235 0.74 SLC18A3 (0.40) SLC18A3SIGMAR1NPY5RP2RY1FFAR1
SCHEMBL11094423 0.73 AKT1 (0.49) SLC18A3SIGMAR1NPY5RP2RY1NOTUM

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-4379933-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