SCHEMBL7658990

SCHEMBL7658990

CCOC(=O)c1cc(N2CCCC2)c2cc3c(cc2n1)OCO3

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OGA O60502 1/20 0.45
KDM4E B2RXH2 8/20 0.44
ALDH1A1 P00352 8/20 0.44
HPGD P15428 6/20 0.43
ATM Q13315 1/20 0.43
SMN1; SMN2 Q16637 5/20 0.43
LMNA P02545 4/20 0.43
TGFBR1 P36897 1/20 0.41
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
RXFP1 Q9HBX9 1/20 0.41
SIRT2 Q8IXJ6 3/20 0.41
SIRT1 Q96EB6 2/20 0.41
KMT2A Q03164 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
THRB P10828 1/20 0.40

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
SCHEMBL7655787 0.99 OGA (0.44) OGAKDM4EALDH1A1HPGDATM
SCHEMBL7657251 0.91 L3MBTL1 (0.44) OGAKDM4EALDH1A1HPGDATM
SCHEMBL7653917 0.91 OGA (0.46) OGAKDM4EALDH1A1HPGDATM
SCHEMBL7660385 0.81 OGA (0.42) OGAKDM4EALDH1A1HPGDATM
SCHEMBL7657240 0.80 HPGD (0.47) OGAKDM4EALDH1A1HPGDATM
SCHEMBL7656216 0.80 OGA (0.42) OGAKDM4EALDH1A1HPGDATM
SCHEMBL8211686 0.73 HPGD (0.45) KDM4EALDH1A1HPGDSMN1; SMN2NPC1
SCHEMBL7663203 0.72 OGA (0.43) OGAKDM4EALDH1A1HPGDATM
SCHEMBL7661575 0.72 PIK3CB (0.43) OGAKDM4EALDH1A1HPGDATM
SCHEMBL18520604 0.70 NPC1 (0.44) KDM4EALDH1A1HPGDSMN1; SMN2LMNA

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