SCHEMBL11536829

SCHEMBL11536829

Oc1ccc2ccccc2c1C(c1ccc(Cl)c(Cl)c1)c1c(O)ccc2ccccc12

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
HTT P42858 4/20 0.45
NPSR1 Q6W5P4 3/20 0.45
LMNA P02545 2/20 0.45
MAPT P10636 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MDM2 Q00987 1/20 0.44
AHR P35869 1/20 0.44
ABCG2 Q9UNQ0 1/20 0.44
KDM4E B2RXH2 4/20 0.42
ALDH1A1 P00352 3/20 0.42
GAA P10253 2/20 0.41
PTPN22 Q9Y2R2 1/20 0.41
CYP2A6 P11509 1/20 0.41
NQO1 P15559 1/20 0.40
HPGD P15428 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
SCHEMBL11537513 0.84 NQO1 (0.54) MEN1KMT2AHTTNPSR1LMNA
SCHEMBL17787304 0.83 MEN1 (0.58) MEN1KMT2AHTTNPSR1LMNA
SCHEMBL11539377 0.82 MEN1 (0.45) MEN1KMT2AHTTNPSR1LMNA
SCHEMBL11534831 0.82 TNF (0.49) MEN1KMT2AHTTNPSR1LMNA
SCHEMBL11539885 0.80 AHR (0.53) MEN1KMT2AHTTNPSR1LMNA
SCHEMBL9423470 0.79 AHR (0.52) MEN1KMT2AHTTNPSR1LMNA
SCHEMBL30738449 0.79 MEN1 (0.56) MEN1KMT2AHTTNPSR1LMNA
SCHEMBL9423648 0.79 MEN1 (0.56) MEN1KMT2AHTTNPSR1LMNA
SCHEMBL11537803 0.78 MEN1 (0.48) MEN1KMT2AHTTNPSR1LMNA
SCHEMBL11533644 0.77 MEN1 (0.46) MEN1KMT2AHTTNPSR1LMNA

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-4147806-A Anti-inflammatory and analgesic medicaments LABORATOIRES CREAT (FR) 1979-04-03 US claimed
US-4147806-A Anti-inflammatory and analgesic medicaments LABORATOIRES CREAT (FR) 1979-04-03 US disclosed