SCHEMBL9305932

SCHEMBL9305932

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

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 1/20 0.58
RAB9A P51151 5/20 0.54
NPC1 O15118 4/20 0.54
ALDH1A1 P00352 3/20 0.53
HPGD P15428 3/20 0.53
CYP3A4 P08684 2/20 0.53
MAPK1 P28482 2/20 0.53
MAOB P27338 6/20 0.52
KMT2A Q03164 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
MAPT P10636 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.50
LMNA P02545 1/20 0.50
CYP1A2 P05177 1/20 0.50
PGR P06401 1/20 0.50
CYP2D6 P10635 1/20 0.50
SLC6A2 P23975 1/20 0.50

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
SCHEMBL9303488 0.97 PPARD (0.62) PPARDRAB9ANPC1ALDH1A1HPGD
SCHEMBL51025 0.95 PPARD (0.56) PPARDRAB9ANPC1ALDH1A1HPGD
SCHEMBL29378251 0.95 PPARD (0.56) PPARDRAB9ANPC1ALDH1A1HPGD
SCHEMBL26936 0.94 PPARD (0.55) PPARDRAB9ANPC1ALDH1A1HPGD
SCHEMBL7761012 0.91 APP (0.55) PPARDRAB9ANPC1ALDH1A1HPGD
SCHEMBL8062812 0.91 APP (0.55) PPARDRAB9ANPC1ALDH1A1HPGD
SCHEMBL3657870 0.89 PPARD (0.56) PPARDALDH1A1MAOB
SCHEMBL9304812 0.88 MCL1 (0.54) PPARDRAB9ANPC1ALDH1A1HPGD
SCHEMBL10594049 0.88 NPC1 (0.54) PPARDRAB9ANPC1ALDH1A1HPGD
SCHEMBL8053343 0.88 PPARD (0.57) PPARDALDH1A1MAOBPKM

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