SCHEMBL7523711

SCHEMBL7523711

CCCNC(=O)Oc1nc(Cl)c(C)cc1C(=O)Nc1cccc(Cl)c1C

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.51
NPC1 O15118 2/20 0.51
HTT P42858 2/20 0.47
ALDH1A1 P00352 2/20 0.46
MAPT P10636 2/20 0.44
LMNA P02545 1/20 0.43
THRB P10828 1/20 0.42
KMT2A Q03164 2/20 0.42
AGER Q15109 1/20 0.41
PTGES O14684 1/20 0.41

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
SCHEMBL7456728 0.87 HTT (0.47) RAB9ANPC1HTTALDH1A1MAPT
SCHEMBL7460958 0.75 GAA (0.40) RAB9ANPC1HTTALDH1A1MAPT
SCHEMBL7466102 0.73 ALDH1A1 (0.50) RAB9AALDH1A1MAPTLMNAKMT2A
SCHEMBL8667765 0.71 ALDH1A1 (0.56) RAB9ANPC1HTTALDH1A1MAPT
SCHEMBL7459262 0.71 EPHX1 (0.54) RAB9ANPC1ALDH1A1MAPTLMNA
SCHEMBL7461854 0.71 ALDH1A1 (0.41) RAB9ANPC1HTTALDH1A1MAPT
SCHEMBL7458253 0.69 PDE4A (0.38) RAB9ANPC1HTTALDH1A1THRB
SCHEMBL8664999 0.67 HTT (0.46) RAB9ANPC1HTTALDH1A1MAPT
SCHEMBL6949794 0.67 HDAC1 (0.36) THRBKMT2A
SCHEMBL7456776 0.65 PDE4A (0.37) RAB9ANPC1HTTALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2002540193-A 2002-11-26 JP claimed
EP-1165515-A1 PYRIDINE-2,3-DICARBOXYLIC ACID DIAMIDES BASF AKTIENGESELLSCHAFT (DE) 2002-01-02 EP claimed
WO-2000058288-A1 PYRIDINE-2,3-DICARBOXYLIC ACID DIAMIDES BASF AKTIENGESELLSCHAFT (DE) 2000-10-05 WO claimed