SCHEMBL15430835

SCHEMBL15430835

COCCOCCOCCOC(=O)c1ccc(C)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.59
ABCB11 O95342 1/20 0.59
ADRA2B P18089 1/20 0.59
OPRD1 P41143 1/20 0.59
SCN5A Q14524 1/20 0.59
TDP1 Q9NUW8 2/20 0.53
TSHR P16473 3/20 0.51
RAB9A P51151 4/20 0.49
MAPT P10636 4/20 0.49
NPC1 O15118 3/20 0.49
ALDH1A1 P00352 3/20 0.49
ESR1 P03372 3/20 0.46
CHRM1 P11229 1/20 0.46
SLC6A2 P23975 1/20 0.46
KDR P35968 1/20 0.46
SERPINE1 P05121 1/20 0.46
GAA P10253 2/20 0.45
KMT2A Q03164 1/20 0.45
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44

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
SCHEMBL16130571 1.00 CYP3A4 (0.59) CYP3A4ABCB11ADRA2BOPRD1SCN5A
SCHEMBL756980 0.95 TDP1 (0.59) CYP3A4ABCB11ADRA2BOPRD1SCN5A
SCHEMBL9928660 0.93 CYP3A4 (0.66) CYP3A4ABCB11ADRA2BOPRD1SCN5A
SCHEMBL29735076 0.93 TDP1 (0.55) CYP3A4ABCB11ADRA2BOPRD1SCN5A
SCHEMBL14722813 0.93 TDP1 (0.55) CYP3A4ABCB11ADRA2BOPRD1SCN5A
SCHEMBL29735153 0.93 TDP1 (0.55) CYP3A4ABCB11ADRA2BOPRD1SCN5A
SCHEMBL14926636 0.90 TDP1 (0.53) CYP3A4ABCB11ADRA2BOPRD1SCN5A
SCHEMBL14926665 0.90 TDP1 (0.53) CYP3A4ABCB11ADRA2BOPRD1SCN5A
SCHEMBL9969969 0.87 TSHR (0.64) CYP3A4ABCB11ADRA2BOPRD1SCN5A
SCHEMBL206554 0.87 TDP1 (0.61) CYP3A4TDP1TSHRRAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9601696-B2 Electroluminescent composition and electric device with high brightness SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-03-21 US disclosed
US-9306169-B2 Electronic device, polymer compound, organic compound, and method of producing polymer compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-04-05 US disclosed
US-9306170-B2 Electronic device and polymer compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-04-05 US disclosed
US-20140039131-A1 ELECTRONIC DEVICE AND POLYMER COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-02-06 US disclosed
US-20140024785-A1 ELECTRONIC DEVICE, POLYMER COMPOUND, ORGANIC COMPOUND, AND METHOD OF PRODUCING POLYMER COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-01-23 US disclosed