SCHEMBL18911027

SCHEMBL18911027

CCCc1ccc(C2(O)C3CC4CC(C3)CC2C4)cc1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.39
OPRD1 P41143 1/20 0.39
OPRK1 P41145 1/20 0.39
OPRL1 P41146 1/20 0.39
HSD11B1 P28845 9/20 0.38
LPL P06858 2/20 0.38
LIPG Q9Y5X9 2/20 0.38
THRB P10828 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
PLK1 P53350 1/20 0.34
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33

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
SCHEMBL18911047 0.90 OPRL1 (0.41) OPRL1HSD11B1LPLLIPGTHRB
SCHEMBL7078035 0.86 HSD11B1 (0.40) OPRM1OPRD1OPRK1OPRL1HSD11B1
SCHEMBL18905472 0.83 HSD11B1 (0.37) HSD11B1MEN1KMT2A
SCHEMBL18905317 0.81 HSD11B1 (0.35) HSD11B1MEN1KMT2A
SCHEMBL18911059 0.80 HSD11B1 (0.36) HSD11B1MEN1KMT2ACNR2
SCHEMBL6899610 0.77 HSD11B1 (0.54) HSD11B1MEN1KMT2A
SCHEMBL18910952 0.76 TSHR (0.47) HSD11B1MEN1KMT2APLK1CNR2
SCHEMBL18910945 0.75 ALOX5AP (0.38) OPRM1OPRD1OPRK1OPRL1HSD11B1
SCHEMBL15179667 0.74 NPSR1 (0.39) HSD11B1MEN1KMT2A
SCHEMBL18905336 0.73 HSD11B1 (0.33) HSD11B1MEN1KMT2A

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-20170154766-A1 SILICON-CONTAINING CONDENSATE, COMPOSITION FOR FORMING A SILICON-CONTAINING RESIST UNDER LAYER FILM, AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-06-01 US disclosed