SCHEMBL7657898

SCHEMBL7657898

CCOC(=O)c1cc(-c2ccc(OC)cc2)c2c3c(ccc2n1)OCO3

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 2/20 0.44
SIRT1 Q96EB6 2/20 0.44
SIRT3 Q9NTG7 1/20 0.44
KDM4E B2RXH2 5/20 0.44
ALDH1A1 P00352 4/20 0.44
HPGD P15428 4/20 0.44
GAA P10253 3/20 0.44
MAPT P10636 3/20 0.44
CTSL P07711 2/20 0.44
CTSB P07858 2/20 0.44
RCE1 Q9Y256 1/20 0.44
HSD17B10 Q99714 2/20 0.43
TP53 P04637 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TARBP2 Q15633 2/20 0.43
PDCD4 Q53EL6 1/20 0.43
POLB P06746 1/20 0.42
CASP1 P29466 1/20 0.42
CASP7 P55210 1/20 0.42
GABRA2 P47869 2/20 0.41

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
SCHEMBL7659603 0.89 SIRT2 (0.45) SIRT2SIRT1SIRT3KDM4EALDH1A1
SCHEMBL7662205 0.89 SIRT2 (0.53) SIRT2SIRT1SIRT3KDM4EALDH1A1
SCHEMBL7656191 0.86 CFTR (0.47) KDM4EALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL7659665 0.85 GRM2 (0.54) KDM4EALDH1A1HPGDGAAMAPT
SCHEMBL7658391 0.84 MAPT (0.45) KDM4EALDH1A1HPGDGAAMAPT
SCHEMBL7655647 0.82 MAPT (0.51) KDM4EALDH1A1HPGDGAAMAPT
SCHEMBL7651397 0.78 POLB (0.55) KDM4EALDH1A1HPGDGAAMAPT
SCHEMBL7659132 0.78 KMT2A (0.62) KDM4EALDH1A1MAPTSMN1; SMN2POLB
SCHEMBL7655836 0.78 ALDH1A1 (0.50) KDM4EALDH1A1HPGDGAAMAPT
SCHEMBL7655128 0.77 RAB9A (0.52) MAPTTP53SMN1; SMN2POLBNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6340704-B1 TREATING NERVE DISEASE OR BONE/JOINT DISEASE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-01-22 US disclosed
EP-0975621-A1 CELL DIFFERENTIATION INDUCING AMIDE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 2000-02-02 EP disclosed
WO-1998049155-A1 CELL DIFFERENTIATION INDUCING AMIDE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-11-05 WO disclosed