SCHEMBL9723788

SCHEMBL9723788

CC(=O)Oc1ccc(-c2ccccc2)c(C(=O)O)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 3/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
KDM4E B2RXH2 5/20 0.57
NPC1 O15118 3/20 0.56
POLB P06746 1/20 0.56
RAB9A P51151 2/20 0.53
MEN1 O00255 1/20 0.53
GLA P06280 1/20 0.53
KMT2A Q03164 1/20 0.53
ALDH1A1 P00352 3/20 0.52
MAPT P10636 3/20 0.52
PKM P14618 1/20 0.52
LMNA P02545 1/20 0.51
GAA P10253 1/20 0.51
MAPK1 P28482 1/20 0.51
FOLH1 Q04609 1/20 0.50
TDP1 Q9NUW8 2/20 0.49
HSD17B10 Q99714 2/20 0.49
ELANE P08246 1/20 0.49
ESR1 P03372 1/20 0.49

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
Hydrochloric Acid SCHEMBL9723743 0.98 BACE1 (0.58) BACE1SMN1; SMN2KDM4ENPC1POLB
SCHEMBL30701890 0.90 BACE1 (0.59) BACE1SMN1; SMN2KDM4ENPC1POLB
SCHEMBL30701889 0.90 BACE1 (0.59) BACE1SMN1; SMN2KDM4ENPC1POLB
SCHEMBL7262143 0.88 KDM4E (0.66) BACE1SMN1; SMN2KDM4EALDH1A1MAPT
SCHEMBL9723737 0.88 BACE1 (0.56) BACE1SMN1; SMN2KDM4ENPC1POLB
SCHEMBL10479949 0.87 BACE1 (0.64) BACE1SMN1; SMN2KDM4ENPC1POLB
SCHEMBL8142093 0.86 KDM4E (0.61) BACE1SMN1; SMN2KDM4ENPC1POLB
SCHEMBL10513975 0.85 BACE1 (0.54) BACE1SMN1; SMN2KDM4ENPC1POLB
SCHEMBL5342329 0.83 SMN1; SMN2 (0.84) BACE1SMN1; SMN2KDM4ENPC1POLB
SCHEMBL3824865 0.83 BACE1 (0.63) BACE1SMN1; SMN2KDM4ENPC1POLB

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-1305050-A None JP disclosed
US-5114613-A High-speed responsive, stable films; controlling the mesomorphic state and temperature CANON KABUSHIKI KAISHA (JP) 1992-05-19 US disclosed
JP-H01305050-A PRODUCTION OF P-ACETOXYBIPHENYLCARBOXYLIC ACID MITSUBISHI GAS CHEM CO INC 1989-12-08 JP disclosed
US-4882085-A Lactic acid derivative and liquid crystal composition containing same CANON KABUSHIKI KAISHA (JP) 1989-11-21 US disclosed