SCHEMBL7899686

SCHEMBL7899686

CCc1cc(C(C)(CC(C)C)c2cc(CC)c(OCCO)c(CC)c2)cc(CC)c1OCCO

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.32
HSD17B10 Q99714 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
S1PR1 P21453 1/20 0.32
USP2 O75604 1/20 0.32
LMNA P02545 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
SCHEMBL7899687 0.89 NR1H2 (0.35) CYP3A4HSD17B10SMN1; SMN2USP2LMNA
SCHEMBL7906090 0.84 GAA (0.31) HSD17B10GAAKMT2A
SCHEMBL7912707 0.83 HTR1A (0.38) CYP3A4HSD17B10SMN1; SMN2GAAKMT2A
SCHEMBL7907559 0.82 CYP3A4 (0.33) CYP3A4HSD17B10SMN1; SMN2GAAKMT2A
SCHEMBL7912756 0.82 ESR1 (0.38) CYP3A4HSD17B10SMN1; SMN2GAAKMT2A
SCHEMBL7048814 0.81 ALOX15 (0.37) CYP3A4HSD17B10SMN1; SMN2GAAKMT2A
SCHEMBL7907571 0.81 CYP3A4 (0.33) CYP3A4SMN1; SMN2
SCHEMBL7907575 0.80 HSD17B10 (0.34) CYP3A4HSD17B10SMN1; SMN2GAAKMT2A
SCHEMBL7912734 0.76 ESR1 (0.47) CYP3A4HSD17B10SMN1; SMN2GAAKMT2A
SCHEMBL7907594 0.75 S1PR1 (0.31) HSD17B10GAAKMT2AS1PR1

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