SCHEMBL7377233

SCHEMBL7377233

O=C(O)C(Cc1cccc2c1OCO2)Cc1cccc2c1OCO2

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.47
FAAH O00519 1/20 0.45
MTNR1A P48039 4/20 0.42
CYP1A2 P05177 1/20 0.42
LMNA P02545 2/20 0.41
MT-CO2 P00403 1/20 0.40
ALKBH1 Q13686 1/20 0.40
EED O75530 1/20 0.40
POLB P06746 1/20 0.39
MAPK1 P28482 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL8319482 0.94 KDM4C (0.43) KDM4CFAAHMTNR1ALMNAMT-CO2
SCHEMBL16815337 0.86 KDM4C (0.46) KDM4CFAAHMTNR1ALMNAALKBH1
SCHEMBL16815231 0.86 KDM4C (0.46) KDM4CFAAHMTNR1ALMNAALKBH1
SCHEMBL7444911 0.85 HRH4 (0.44) KDM4CFAAHMTNR1ALMNAMT-CO2
SCHEMBL11759170 0.84 NOS3 (0.46) KDM4CFAAHMTNR1ALMNAPOLB
SCHEMBL11759166 0.84 NOS3 (0.46) KDM4CFAAHMTNR1ALMNAPOLB
SCHEMBL9471736 0.81 KDM4C (0.43) KDM4CFAAHMTNR1ALMNAALKBH1
SCHEMBL28575379 0.78 KDM4C (0.42) KDM4CFAAHMTNR1ALMNAEED
SCHEMBL3402977 0.78 KDM4C (0.50) KDM4CFAAHMTNR1ALMNAALKBH1
SCHEMBL23792241 0.78 MGAM (0.42) KDM4CFAAHMTNR1ALMNAMT-CO2

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
US-4870183-A RENIN INHIBITORS, HYPOTENSIVES KISSEI PHARMACEUTICAL CO., LTD. (JP) 1989-09-26 US disclosed
EP-0252727-A1 Novel amino acid derivatives Kissei Pharmaceutical Co. Ltd. (JP) 1988-01-13 EP disclosed