SCHEMBL14701782

SCHEMBL14701782

CCC(C)(C)Oc1ccc(C(c2ccc(C)cc2)(c2ccc(C)cc2)c2ccc(OC(=O)C(C)(C)CC)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 8/20 0.42
LMNA P02545 2/20 0.38
MAPT P10636 3/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
ABCB11 O95342 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
HTR2A P28223 1/20 0.36
PMP22 Q01453 1/20 0.36
PPARA Q07869 1/20 0.36
TRPM8 Q7Z2W7 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GAA P10253 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
OPRK1 P41145 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
BCHE P06276 1/20 0.33

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
SCHEMBL18056712 0.90 MAPT (0.43) ELANEMAPTRAB9ATDP1L3MBTL1
SCHEMBL12021518 0.87 ELANE (0.51) ELANEABCB11CYP1A2CYP3A4TSHR
SCHEMBL807094 0.86 ELANE (0.46) ELANELMNAABCB11CYP1A2CYP3A4
SCHEMBL12907932 0.85 ELANE (0.44) ELANEMAPTABCB11CYP1A2CYP3A4
SCHEMBL12736999 0.84 ELANE (0.54) ELANELMNAPPARAL3MBTL1GAA
SCHEMBL21030113 0.83 ELANE (0.54) ELANENPC1RAB9AABCB11CYP1A2
SCHEMBL12085813 0.83 ELANE (0.48) ELANEABCB11CYP1A2CYP3A4TSHR
SCHEMBL14701784 0.82 ELANE (0.42) ELANEABCB11CYP1A2CYP3A4TSHR
SCHEMBL13063797 0.82 ELANE (0.42) ELANEMAPTRAB9ATDP1L3MBTL1
SCHEMBL14701715 0.81 ELANE (0.59) ELANEABCB11CYP1A2CYP3A4TSHR

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