SCHEMBL8986023

SCHEMBL8986023

OC1(c2ccc(Cl)cc2)CCCCC1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.64
OPRM1 P35372 2/20 0.56
OPRL1 P41146 2/20 0.56
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
SLC6A4 P31645 7/20 0.52
SLC6A3 Q01959 7/20 0.52
SLC18A3 Q16572 1/20 0.51
CCR3 P51677 1/20 0.50
OPRD1 P41143 1/20 0.49
OPRK1 P41145 1/20 0.49
HSD11B1 P28845 5/20 0.47
SLC6A2 P23975 2/20 0.47
HDAC4 P56524 1/20 0.47

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
SCHEMBL22870543 1.00 DRD2 (0.64) DRD2OPRM1OPRL1MEN1KMT2A
SCHEMBL16249345 0.93 DRD2 (0.67) DRD2OPRM1OPRL1MEN1KMT2A
SCHEMBL29090112 0.88 DRD2 (0.72) DRD2OPRM1OPRL1MEN1KMT2A
SCHEMBL654604 0.81 DRD2 (0.86) DRD2OPRM1OPRL1MEN1KMT2A
SCHEMBL6752708 0.79 ESR1 (0.64) DRD2OPRM1OPRL1MEN1KMT2A
SCHEMBL6058583 0.79 ESR1 (0.64) DRD2OPRM1MEN1KMT2ASLC6A4
SCHEMBL216848 0.78 DRD2 (0.60) DRD2OPRM1OPRL1MEN1KMT2A
SCHEMBL17186803 0.78 DRD2 (0.60) DRD2OPRM1OPRL1MEN1KMT2A
SCHEMBL187716 0.78 DRD2 (1.00) DRD2OPRM1OPRL1MEN1KMT2A
SCHEMBL24845287 0.78 DRD2 (0.43) DRD2OPRM1OPRL1SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5583000-A DETECTING PRESENCE OF RETROVIRAL PROTEASES IN SAMPLE BY COMBINING WITH SPECIFIED COMPOUND AND DETECTING PRESENCE OF COMPLEXES FORMED THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1996-12-10 US disclosed