SCHEMBL3707956

SCHEMBL3707956

C=C(C)C(=O)OC1(c2ccccc2)CC(C)N(C)CC1C

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.57
OPRM1 P35372 4/20 0.54
OPRD1 P41143 4/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
LMNA P02545 2/20 0.46
OPRK1 P41145 3/20 0.44
GAA P10253 1/20 0.44
MAPK1 P28482 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42
DRD3 P35462 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL3704187 0.82 OPRM1 (0.54) ALDH1A1OPRM1OPRD1MEN1KMT2A
Trimeperidine SCHEMBL25235 0.82 OPRM1 (0.76) ALDH1A1OPRM1OPRD1MEN1KMT2A
Trimeperidine SCHEMBL1649689 0.82 OPRM1 (0.76) ALDH1A1OPRM1OPRD1MEN1KMT2A
Trimeperidine SCHEMBL25236 0.82 OPRM1 (0.76) ALDH1A1OPRM1OPRD1MEN1KMT2A
Trimeperidine SCHEMBL9420815 0.81 OPRM1 (0.78) ALDH1A1OPRM1OPRD1MEN1KMT2A
SCHEMBL74935 0.71 ALOX5AP (0.40) ALDH1A1GAAMAPK1NPSR1
SCHEMBL13888474 0.70 ELANE (0.35) ALDH1A1OPRM1OPRD1LMNAOPRK1
SCHEMBL8977860 0.66 LMNA (0.77) ALDH1A1OPRM1OPRD1KMT2ALMNA
Propionic Acid SCHEMBL1610454 0.66 MAPT (0.64) ALDH1A1OPRM1OPRD1MEN1KMT2A
SCHEMBL8977857 0.66 LMNA (0.77) ALDH1A1OPRM1OPRD1KMT2ALMNA

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
US-8808957-B2 Carrier for developing electrostatic image, developer for electrostatic image, developing device, cartridge, process cartridge, image forming method, and image forming apparatus FUJI XEROX CO., LTD. (JP) 2014-08-19 US disclosed
US-20120122028-A1 CARRIER FOR DEVELOPING ELECTROSTATIC IMAGE, DEVELOPER FOR ELECTROSTATIC IMAGE, DEVELOPING DEVICE, CARTRIDGE, PROCESS CARTRIDGE, IMAGE FORMING METHOD, AND IMAGE FORMING APPARATUS FUJI XEROX CO., LTD. (JP) 2012-05-17 US disclosed