SCHEMBL4044977

SCHEMBL4044977

COc1ccc(C(=O)O)c(-c2c(C)c(C)c3oc(C)cc3c2C)c1-c1ccc(C)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
IDO1 P14902 9/20 0.37
GPR35 Q9HC97 1/20 0.37
ACLY P53396 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
FABP3 P05413 1/20 0.36
FABP4 P15090 1/20 0.36
FABP5 Q01469 1/20 0.36
BCL9 O00512 1/20 0.35
CTNNB1 P35222 1/20 0.35
CNR2 P34972 1/20 0.35
LTB4R Q15722 1/20 0.35
TP53 P04637 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
SCHEMBL4044393 0.89 GPR35 (0.39) KDM4ENPC1ALDH1A1MAPK1RAB9A
SCHEMBL73952 0.74 ALDH1A1 (0.47) KDM4ENPC1ALDH1A1MAPK1RAB9A
SCHEMBL4988220 0.70 FABP3 (0.57) KDM4ENPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL4040809 0.67 GPR35 (0.42) KDM4ENPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL1921738 0.66 ALDH1A1 (0.57) KDM4ENPC1ALDH1A1MAPK1RAB9A
SCHEMBL14369633 0.66 PDE4A (0.53) KDM4EALDH1A1MAPK1HSD17B10MAPT
SCHEMBL74506 0.65 PDE4A (0.46) KDM4EALDH1A1MAPK1MAPTTSHR
SCHEMBL91954 0.64 CSNK2A1 (0.59) KDM4ENPC1ALDH1A1MAPK1RAB9A
SCHEMBL30100430 0.64 CSNK2A1 (0.59) KDM4ENPC1ALDH1A1MAPK1RAB9A
SCHEMBL18100489 0.64 PTGS2 (0.41) KDM4ENPC1ALDH1A1RAB9ASMN1; SMN2

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
EP-1323716-B1 PROMOTERS FOR THE PROLIFERATION AND DIFFERENTIATION OF STEM CELLS AND/OR NEURON PRECURSOR CELLS TAKEDA PHARMACEUTICAL (JP) 2009-01-14 EP claimed
EP-1323716-B1 PROMOTERS FOR THE PROLIFERATION AND DIFFERENTIATION OF STEM CELLS AND/OR NEURON PRECURSOR CELLS TAKEDA PHARMACEUTICAL (JP) 2009-01-14 EP disclosed