SCHEMBL20830397

SCHEMBL20830397

O=C1c2ccnc3c(O)ccc(c23)C(=O)N1Cc1cccc(Cl)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.58
MEN1 O00255 3/20 0.58
KDM4E B2RXH2 3/20 0.58
HPGD P15428 1/20 0.58
MAPT P10636 3/20 0.51
LMNA P02545 2/20 0.51
RGS12 O14924 1/20 0.51
USP2 O75604 1/20 0.51
HTT P42858 1/20 0.51
RECQL P46063 1/20 0.51
MAPK1 P28482 1/20 0.50
CASP6 P55212 1/20 0.46
NPSR1 Q6W5P4 1/20 0.45
TYR P14679 1/20 0.45
CYP1B1 Q16678 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
EGLN1 Q9GZT9 1/20 0.43
ATM Q13315 2/20 0.43
UBE2N P61088 1/20 0.43
CACNA1G O43497 2/20 0.42

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
SCHEMBL16965549 0.88 KMT2A (0.61) KMT2AMEN1KDM4EHPGDMAPT
SCHEMBL20830735 0.87 MEN1 (0.47) KMT2AMEN1KDM4EHPGDMAPT
SCHEMBL20830510 0.85 APAF1 (0.45) KMT2AMEN1KDM4EHPGDMAPT
SCHEMBL20830399 0.81 CA12 (0.47) KMT2AMEN1MAPTLMNARGS12
SCHEMBL20830748 0.81 MEN1 (0.46) KMT2AMEN1MAPTLMNARGS12
SCHEMBL20830398 0.81 MEN1 (0.46) KMT2AMEN1KDM4EMAPTLMNA
SCHEMBL20814679 0.81 CYP1A2 (0.52) KMT2AMEN1KDM4EHPGDMAPT
SCHEMBL16964861 0.81 CA1 (0.47) KMT2AMEN1MAPTLMNARGS12
SCHEMBL16965659 0.78 CLTC (0.43) KMT2AMEN1KDM4EHPGDMAPT
SCHEMBL16965144 0.78 KDM4E (0.55) KMT2AMEN1KDM4EMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2900239-B1 DIHYDRO-6-AZAPHENALENE DERIVATIVES FOR THE TREATMENT OF CNS, OCULAR DISEASES AND RELATED DISORDERS WARNER BABCOCK INST FOR GREEN CHEMISTRY LLC (US) 2019-03-20 EP disclosed