SCHEMBL9769326

SCHEMBL9769326

CCCC[CH]Oc1ccc(C(C)(C)CC(C)(C)C)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.36
CYP3A4 P08684 4/20 0.36
USP2 O75604 3/20 0.36
MEN1 O00255 2/20 0.36
TP53 P04637 2/20 0.36
MAPT P10636 2/20 0.36
KMT2A Q03164 2/20 0.36
ESR1 P03372 1/20 0.36
PGR P06401 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
AR P10275 1/20 0.36
DRD1 P21728 1/20 0.36
PTGS1 P23219 1/20 0.36
SLC6A2 P23975 1/20 0.36
PDE4A P27815 1/20 0.36
MAPK1 P28482 1/20 0.36
CASP1 P29466 1/20 0.36
SLC6A4 P31645 1/20 0.36
OPRM1 P35372 1/20 0.36
DRD3 P35462 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
SCHEMBL9770228 0.89 ACACB (0.36) SMN1; SMN2MEN1MAPTKMT2AMAPK1
SCHEMBL9769331 0.87 CNR2 (0.44) CNR1CNR2
SCHEMBL9769414 0.82 CNR2 (0.36) SMN1; SMN2CYP3A4USP2MEN1MAPT
SCHEMBL10741308 0.77 TDP1 (0.47) SMN1; SMN2MEN1MAPTKMT2APGR
SCHEMBL9769309 0.75 CNR2 (0.36) SMN1; SMN2MEN1MAPTKMT2AMAPK1
SCHEMBL5394859 0.74 MAPK1 (0.47) SMN1; SMN2MEN1MAPTKMT2AMAPK1
SCHEMBL12646271 0.71 PPARA (0.41) SMN1; SMN2CYP3A4USP2MEN1TP53
SCHEMBL10908204 0.71 MAPT (0.35) MAPTESR1PGRMAPK1CYP2C19
SCHEMBL12220658 0.69 TAS1R3 (0.44) SMN1; SMN2CYP3A4USP2MEN1TP53
SCHEMBL7454444 0.69 MAPK1 (0.45) SMN1; SMN2MEN1MAPTKMT2AESR1

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-4994209-A Optically transparent solid solution of organic compound in polymer FUJI PHOTO FILM CO., LTD. (JP) 1991-02-19 US disclosed