SCHEMBL7991948

SCHEMBL7991948

CCCCCCCCCCCCOc1ccc(C=C(C)c2ccc(OCCCCCCCCCCCC)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.58
TSHR P16473 1/20 0.58
PLA2G4B P0C869 6/20 0.56
NR5A1 Q13285 1/20 0.56
RARB P10826 3/20 0.54
GAA P10253 2/20 0.54
NPC1 O15118 1/20 0.54
LMNA P02545 1/20 0.54
MAPT P10636 1/20 0.54
ALOX15 P16050 1/20 0.54
RAB9A P51151 1/20 0.54
HSD17B10 Q99714 1/20 0.54
PLA2G4A P47712 2/20 0.52
SLC2A1 P11166 2/20 0.50
THRA P10827 1/20 0.49
THRB P10828 1/20 0.49

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
SCHEMBL11854557 0.95 ESR1 (0.52) TP53TSHRPLA2G4BNR5A1GAA
SCHEMBL11807886 0.94 NQO2 (0.54) TP53TSHRPLA2G4BNR5A1RARB
SCHEMBL9245810 0.88 TP53 (0.53) TP53TSHRPLA2G4BRARBNPC1
SCHEMBL9245818 0.88 TP53 (0.53) TP53TSHRPLA2G4BRARBNPC1
SCHEMBL14198010 0.85 NR5A1 (0.61) TP53TSHRPLA2G4BNR5A1RARB
SCHEMBL12016648 0.85 TP53 (0.63) TP53TSHRPLA2G4BNR5A1RARB
SCHEMBL7032077 0.85 TP53 (0.63) TP53TSHRPLA2G4BNR5A1RARB
SCHEMBL9246164 0.83 TDP1 (0.52) TP53TSHRLMNAMAPT
SCHEMBL9799775 0.83 TDP1 (0.52) TP53TSHRLMNAMAPT
SCHEMBL14561704 0.81 NQO2 (0.50) GAAMAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0982621-B1 Film for optical elements NIPPON MITSUBISHI OIL CORP (JP) 2012-10-10 EP disclosed
US-6294229-B1 Film for optical elements NIPPON MITSUBISHI OIL COMPANY (JP) 2001-09-25 US disclosed
EP-0982621-A2 Film for optical elements Nippon Mitsubishi Oil Corporation (JP) 2000-03-01 EP disclosed