SCHEMBL9304812

SCHEMBL9304812

COc1ccc(OCCCCOc2ccc(O)c(C(=O)O)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 2/20 0.54
RAB9A P51151 3/20 0.51
NPC1 O15118 2/20 0.51
POLB P06746 1/20 0.51
APEX1 P27695 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.49
PTPN11 Q06124 2/20 0.49
TP53 P04637 2/20 0.49
MAPT P10636 2/20 0.49
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
HPGD P15428 1/20 0.49
ALOX12 P18054 1/20 0.49
KMT2A Q03164 1/20 0.49
HSD17B10 Q99714 1/20 0.49
PPARD Q03181 1/20 0.48

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
SCHEMBL9305419 0.97 MCL1 (0.54) MCL1RAB9ANPC1POLBAPEX1
SCHEMBL9305720 0.95 NPC1 (0.52) MCL1RAB9ANPC1POLBAPEX1
SCHEMBL8943610 0.94 NPC1 (0.51) MCL1RAB9ANPC1POLBAPEX1
SCHEMBL13974898 0.89 IGF1R (0.55) MCL1TDP1MEN1KMT2ANFKB1
SCHEMBL9305932 0.88 PPARD (0.58) RAB9ANPC1POLBAPEX1TDP1
SCHEMBL9303988 0.88 MCL1 (0.57) MCL1PTPN11MAPTKDM4EALDH1A1
SCHEMBL9285957 0.86 MCL1 (0.66) MCL1PTPN11TP53
SCHEMBL9191985 0.86 HTT (0.51) MCL1L3MBTL1SMN1; SMN2KDM4EMEN1
SCHEMBL1576849 0.86 MCL1 (0.69) MCL1PTPN11TP53
SCHEMBL29623897 0.86 MCL1 (0.69) MCL1PTPN11TP53

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-5276001-A Color developer comprising salicylic acid derivative KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1994-01-04 US disclosed