SCHEMBL14700488

SCHEMBL14700488

COc1ccc(-c2ccc(-c3ccc(OC(C)=O)cc3C)cc2)c(C)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 4/20 0.59
SMN1; SMN2 Q16637 2/20 0.51
KDM4E B2RXH2 2/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
ACHE P22303 1/20 0.47
ALDH1A1 P00352 1/20 0.47
F2 P00734 1/20 0.47
GLA P06280 1/20 0.47
HPGD P15428 1/20 0.47
GAPDH P04406 2/20 0.46
LMNA P02545 2/20 0.46
HSD17B10 Q99714 2/20 0.45
ACACB O00763 1/20 0.45
ACACA Q13085 1/20 0.45
TP53 P04637 1/20 0.45
CYP3A4 P08684 1/20 0.45
EPHX1 P07099 1/20 0.45

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
SCHEMBL12305402 0.97 BACE1 (0.64) BACE1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL4198689 0.92 LMNA (0.55) BACE1KDM4EACHEALDH1A1GLA
SCHEMBL14700515 0.92 BACE1 (0.51) BACE1SMN1; SMN2KDM4EACHEALDH1A1
SCHEMBL17860073 0.86 BACE1 (0.46) BACE1KDM4EACHEALDH1A1GLA
SCHEMBL28663436 0.85 SLC2A1 (0.54) BACE1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL28656189 0.84 HSD17B10 (0.66) BACE1KDM4EACHEALDH1A1LMNA
SCHEMBL5582943 0.84 ACHE (0.58) SMN1; SMN2KDM4EACHEALDH1A1GLA
SCHEMBL4085836 0.84 HSD17B1 (0.64) BACE1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL16488962 0.83 BACE1 (0.55) BACE1SMN1; SMN2KDM4ECYP1A2CYP2D6
SCHEMBL679848 0.82 SMN1; SMN2 (0.55) BACE1SMN1; SMN2KDM4ECYP1A2CYP2D6

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-20130040234-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR, MANUFACTURING METHOD THEREFOR AND ELECTROPHOTOGRAPHIC DEVICE FUJI ELECTRIC CO., LTD. (JP) 2013-02-14 US disclosed