SCHEMBL7906139

SCHEMBL7906139

Cc1cc(C2(c3cc(C)c(OCCO)c(C)c3)CCCCCCC2)cc(C)c1OCCO

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.54
ESR1 P03372 3/20 0.46
ESR2 Q92731 3/20 0.46
HTR1A P08908 3/20 0.40
LMNA P02545 3/20 0.40
ALOX12 P18054 3/20 0.40
ALDH1A1 P00352 2/20 0.40
PPARA Q07869 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
S1PR1 P21453 4/20 0.37
S1PR3 Q99500 3/20 0.37
PSMB1 P20618 1/20 0.34
PSMB5 P28074 1/20 0.34
PSMB2 P49721 1/20 0.34
BRD4 O60885 1/20 0.34
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL5503980 1.00 ACHE (0.54) ACHEESR1ESR2HTR1ALMNA
SCHEMBL7909268 1.00 ACHE (0.54) ACHEESR1ESR2HTR1ALMNA
SCHEMBL7907579 0.98 ACHE (0.51) ACHEESR1ESR2HTR1ALMNA
SCHEMBL5493886 0.81 ACHE (0.40) ACHEESR1ESR2LMNAALOX12
SCHEMBL7906100 0.81 ACHE (0.40) ACHEESR1ESR2LMNAALOX12
SCHEMBL7909231 0.81 ACHE (0.40) ACHEESR1ESR2LMNAALOX12
SCHEMBL11763224 0.81 ACHE (0.39) ACHEESR1ESR2LMNAALDH1A1
SCHEMBL7907552 0.80 PPARA (0.54) ACHEESR1ESR2LMNAALOX12
SCHEMBL9818192 0.80 PPARA (0.54) ACHEESR1ESR2LMNAALOX12
SCHEMBL7908966 0.80 PPARA (0.54) ACHEESR1ESR2LMNAALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6187493-B1 CHARGE GENERATING MATERIAL AND ELECTRON TRANSFER MATERIAL UNIFORMLY DISPERSED WITHIN COMPATIBLE POLYESTER BINDER; PHOTOSENSITIVITY, WEAR RESISTANCE, ADHESION TO ELECTROCONDUCTIVE SUBSTRATE KYOCERA MITA CORPORATION (JP) 2001-02-13 US disclosed
EP-0738934-A2 Electrophotosensitive material MITA INDUSTRIAL CO., LTD. (JP) 1996-10-23 EP disclosed