SCHEMBL7001447

SCHEMBL7001447

Cn1c2cc(Cl)ccc2c2c(C(=O)O)nn(-c3cccc(Cl)c3)c(=O)c21

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSPO P30536 1/20 0.62
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
MAPT P10636 3/20 0.47
TP53 P04637 3/20 0.47
POLB P06746 1/20 0.46

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
SCHEMBL5702445 0.96 TSPO (0.67) TSPOMAPTTP53POLB
SCHEMBL7001998 0.93 TSPO (0.57) TSPOKDM4EALDH1A1MAPTTP53
SCHEMBL7002472 0.92 TSPO (0.56) TSPOKDM4EALDH1A1MAPTTP53
SCHEMBL7626011 0.89 TSPO (0.64) TSPOMAPTTP53
SCHEMBL7498096 0.87 TSPO (0.56) TSPOKDM4EALDH1A1MAPTTP53
SCHEMBL6999958 0.86 TSPO (0.54) TSPOKDM4EALDH1A1MAPTTP53
SCHEMBL7626419 0.86 TSPO (0.58) TSPOALDH1A1MAPTTP53
SCHEMBL7003823 0.85 TSPO (0.71) TSPOKDM4EALDH1A1MAPTTP53
SCHEMBL6703839 0.85 SMN1; SMN2 (0.54) TSPOALDH1A1MAPTTP53POLB
SCHEMBL7631555 0.83 TSPO (0.65) TSPOKDM4EALDH1A1MAPT

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-1149101-B1 4-OXO-3,5-DIHYDRO-4$i(H)-PYRIDAZINO 4,5-$i(b)]INDOLE-1-CARBOXAMIDE DERIVATIVES, PREPARATION AND THERAPEUTIC USE SANOFI SYNTHELABO (FR) 2003-04-09 EP disclosed