SCHEMBL1688916

SCHEMBL1688916

Cc1nccc(-c2ccc(-c3nc4nn(-c5ccccc5)cc4c(=O)n3-c3ccc(Cl)cc3)cc2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 6/20 0.41
MAPT P10636 2/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
HSP90AA1 P07900 1/20 0.40
CNR1 P21554 2/20 0.40
GPR55 Q9Y2T6 2/20 0.40
CNR2 P34972 1/20 0.40
GRM5 P41594 1/20 0.39
GRM1 Q13255 1/20 0.39
HTT P42858 1/20 0.39
GAA P10253 1/20 0.38
GPR35 Q9HC97 1/20 0.38
TP53 P04637 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
RAB9A P51151 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
MDM2 Q00987 1/20 0.37

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
SCHEMBL1688944 0.90 PKM (0.46) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL5611446 0.88 MAPT (0.43) ALDH1A1MAPTMEN1KMT2AHSP90AA1
SCHEMBL1689138 0.86 ALDH1A1 (0.53) LMNAALDH1A1MAPTMEN1KMT2A
SCHEMBL5611687 0.86 MAPT (0.52) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL1689243 0.86 MAPT (0.51) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL1689427 0.85 MAPT (0.44) ALDH1A1MAPTMEN1KMT2AHSP90AA1
SCHEMBL1688932 0.85 MAPT (0.40) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL1689094 0.85 ALDH1A1 (0.52) LMNAALDH1A1MAPTMEN1KMT2A
SCHEMBL5611833 0.84 MAPT (0.41) LMNAALDH1A1MAPTMEN1KMT2A
SCHEMBL1689325 0.84 MAPT (0.41) ALDH1A1MAPTMEN1KMT2AHSP90AA1

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
EP-1807429-A2 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM, LLC (BM) 2007-07-18 EP claimed
WO-2006047516-A2 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2006-05-04 WO claimed