SCHEMBL16601799

SCHEMBL16601799

CC(C)(C)c1ccc(C2=CC(=C3C=C(c4ccc(CO)cc4)C(=O)C(c4ccc(CO)cc4)=C3)C=C(c3ccc(C(C)(C)C)cc3)C2=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.47
RECQL P46063 1/20 0.39
ERCC5 P28715 1/20 0.39
FEN1 P39748 1/20 0.39
TP53 P04637 1/20 0.38
TSHR P16473 1/20 0.38
IKBKB O14920 1/20 0.38
GRIA4 P48058 1/20 0.37
METAP2 P50579 1/20 0.37
ESRRG P62508 1/20 0.36
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
CSF1R P07333 1/20 0.35
EPHX1 P07099 1/20 0.35
P4HB P07237 1/20 0.35
NPC1 O15118 1/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
MMP2 P08253 1/20 0.35

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
SCHEMBL821120 0.79 EPHX2 (0.56) EPHX2RECQLERCC5FEN1TP53
SCHEMBL113722 0.77 EPHX2 (0.61) EPHX2RECQLTP53TSHRIKBKB
SCHEMBL16601763 0.72 HSD17B3 (0.49) TSHRMAPT
SCHEMBL12017412 0.70 RAB9A (0.69) EPHX2RECQLESRRGNPC1MAPT
SCHEMBL15764229 0.69 MEN1 (0.36) TP53MAPTMMP2MMP9MMP8
SCHEMBL10392943 0.68 SRD5A2 (0.67) EPHX2RXRARXRBRXRGRAB9A
SCHEMBL15764225 0.68 BACE1 (0.68) TP53MAPT
SCHEMBL3080649 0.68 KDM4E (0.58) EPHX2ERCC5FEN1TP53IKBKB
SCHEMBL28342705 0.68 BACE1 (0.66) TP53NPC1MAPTRAB9A
SCHEMBL13863328 0.67 CYP1A2 (0.53) EPHX2TP53TSHRNPC1MAPT

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-8993205-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-03-31 US disclosed
US-8993205-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-03-31 US disclosed