SCHEMBL9407936

SCHEMBL9407936

CC1(c2ccccc2)CCCC(C)(c2ccccc2)N1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.41
OPRK1 P41145 1/20 0.41
OPRL1 P41146 1/20 0.41
DPP4 P27487 1/20 0.38
HTR2A P28223 1/20 0.38
AKR1C1 Q04828 1/20 0.38
MMP2 P08253 1/20 0.38
MMP9 P14780 1/20 0.38
SLC6A4 P31645 2/20 0.37
SLC6A2 P23975 1/20 0.37
SLC6A3 Q01959 1/20 0.37

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
SCHEMBL6544207 0.91 OPRM1 (0.44) OPRM1OPRK1OPRL1HTR2AMMP2
SCHEMBL31504290 0.90 HTR2A (0.38) OPRM1OPRK1OPRL1DPP4HTR2A
SCHEMBL31504306 0.80 HTR2A (0.41) OPRM1OPRK1OPRL1HTR2AMMP2
SCHEMBL21312268 0.78 OPRM1 (0.42) OPRM1OPRK1OPRL1HTR2A
SCHEMBL15995122 0.78 OPRM1 (0.42) OPRM1OPRK1OPRL1HTR2A
SCHEMBL15995119 0.78 OPRM1 (0.42) OPRM1OPRK1OPRL1HTR2A
SCHEMBL10708233 0.77 OPRM1 (0.41) OPRM1OPRK1OPRL1DPP4HTR2A
SCHEMBL28483016 0.74 OPRM1 (0.38) OPRM1OPRK1OPRL1DPP4HTR2A
SCHEMBL353050 0.73 OPRL1 (0.46) OPRM1OPRK1OPRL1DPP4AKR1C1
SCHEMBL1071202 0.73 HTR2A (0.41) OPRM1OPRK1OPRL1HTR2AMMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11834527-B1 Poly alpha-olefins, compositions thereof, and methods of making Western Performance Chemicals, LLC (US) 2023-12-05 US disclosed
US-5276116-A Blend of olefin-divinylbenzene copolymer with vinyl siloxane copolymer with a catalyst CONOCO INC. (US) 1994-01-04 US disclosed
US-5028574-A Coordination catalysts for producing high molecular weight addition polymers, less drag in pipelines CONOCO INC. (US) 1991-07-02 US disclosed
US-4952738-A COPOLYMER OF ALPHA OLEFINS AND DIVINYLBENZENE OR VINYL SILOXANE DISSOLVED IN A HYDROCARBON LIQUID CONOCO INC. (US) 1990-08-28 US disclosed