SCHEMBL7129918

SCHEMBL7129918

Oc1ccc(-c2ccccc2)cc1-c1c(Cl)ccc2[nH]nnc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.44
LMNA P02545 3/20 0.40
MAPT P10636 3/20 0.40
HPGD P15428 3/20 0.40
MEN1 O00255 2/20 0.40
ALOX15 P16050 2/20 0.40
KMT2A Q03164 2/20 0.40
MAPK1 P28482 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
BIRC5 O15392 1/20 0.38
HPN P05981 1/20 0.38
PRKAB2 O43741 3/20 0.37
PRKAG1 P54619 3/20 0.37
PRKAA2 P54646 3/20 0.37
PRKAA1 Q13131 3/20 0.37
PRKAG3 Q9UGI9 3/20 0.37
PRKAG2 Q9UGJ0 3/20 0.37
PRKAB1 Q9Y478 3/20 0.37
ALOX5 P09917 1/20 0.37
DHODH Q02127 1/20 0.35

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
SCHEMBL30117209 0.83 MEN1 (0.39) LMNAMAPTHPGDMEN1ALOX15
SCHEMBL6064915 0.83 MEN1 (0.39) LMNAMAPTHPGDMEN1ALOX15
SCHEMBL8847324 0.81 IDO1 (0.38) LMNAMAPTHPGDMEN1ALOX15
SCHEMBL27447355 0.79 AKT2 (0.37) HPGDKMT2AMAPK1NPSR1TP53
SCHEMBL11075897 0.78 ALDH1A1 (0.37) LMNAMAPTHPGDMEN1ALOX15
SCHEMBL27447008 0.78 BRAF (0.34) HPNGAABRAF
SCHEMBL31570221 0.78 ALDH1A1 (0.37) LMNAMAPTHPGDMEN1ALOX15
SCHEMBL8773836 0.77 BACE1 (0.39) MAPTALOX15PRKAB2PRKAG1PRKAA2
SCHEMBL80394 0.76 CHEK1 (0.37) ESR2MAPTALOX5HTTCLK2
SCHEMBL29359068 0.76 CHEK1 (0.37) ESR2MAPTALOX5HTTCLK2

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-0852251-B1 STAIN-PROOFING AGENT FOR PREVENTING ADHERENCE OF STAIN AND COMPOSITION FOR PAINTS DAIKIN IND LTD (JP) 2003-05-28 EP disclosed