SCHEMBL8535923

SCHEMBL8535923

O=C(O)CCC(=O)c1ccc2c(c1)Cc1ccccc1-2

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 2/20 0.69
KDM4E B2RXH2 3/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
HTR2C P28335 2/20 0.55
HTR2B P41595 2/20 0.55
DRD2 P14416 1/20 0.55
ADRA1D P25100 1/20 0.55
HTR2A P28223 1/20 0.55
HTR7 P34969 1/20 0.55
ADRA1A P35348 1/20 0.55
ADRA1B P35368 1/20 0.55
NR4A2 P43354 1/20 0.53
ALDH1A1 P00352 4/20 0.52
LMNA P02545 3/20 0.52
GAA P10253 2/20 0.52
NPSR1 Q6W5P4 1/20 0.52
CYP1A2 P05177 4/20 0.51
RAB9A P51151 2/20 0.51
FFAR1 O14842 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51

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
SCHEMBL1114930 0.92 RAB9A (0.56) SRD5A2KDM4EL3MBTL1NR4A2ALDH1A1
SCHEMBL503179 0.89 SRD5A2 (0.67) SRD5A2KDM4EL3MBTL1NR4A2ALDH1A1
SCHEMBL11844589 0.84 SRD5A2 (0.64) SRD5A2KDM4EL3MBTL1HTR2CHTR2B
SCHEMBL25188173 0.84 SRD5A2 (0.64) SRD5A2KDM4EL3MBTL1HTR2CHTR2B
SCHEMBL27363308 0.84 SRD5A2 (0.64) SRD5A2KDM4EL3MBTL1HTR2CHTR2B
SCHEMBL10994744 0.84 SRD5A2 (0.68) SRD5A2KDM4EL3MBTL1HTR2CHTR2B
SCHEMBL2561144 0.83 SRD5A2 (0.62) SRD5A2KDM4EL3MBTL1HTR2CHTR2B
SCHEMBL10967373 0.83 SRD5A2 (0.66) SRD5A2KDM4EL3MBTL1HTR2CHTR2B
SCHEMBL7786912 0.83 SRD5A2 (0.66) SRD5A2KDM4EL3MBTL1HTR2CHTR2B
SCHEMBL10968921 0.83 SRD5A2 (0.66) SRD5A2KDM4EL3MBTL1HTR2CHTR2B

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
CN-1216522-A Therapeutic agent for diabetes JAPAN TOBACCO INC (JP) 1999-05-12 CN disclosed
EP-0885869-A1 THERAPEUTIC AGENT FOR DIABETES Japan Tobacco Inc. (JP) 1998-12-23 EP disclosed