SCHEMBL15955705

SCHEMBL15955705

Cc1ccc(Sc2cc(Cl)c(N)c(Cl)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 1/20 0.41
MAPT P10636 5/20 0.40
ALDH1A1 P00352 4/20 0.40
MAPK1 P28482 3/20 0.40
L3MBTL1 Q9Y468 3/20 0.40
PDE7A Q13946 2/20 0.40
HPGD P15428 2/20 0.40
ALOX15 P16050 2/20 0.40
HSD17B10 Q99714 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
GAA P10253 1/20 0.40
CYP3A4 P08684 2/20 0.39
TSHR P16473 1/20 0.39
MLYCD O95822 1/20 0.38
MCL1 Q07820 2/20 0.38
BCL2 P10415 1/20 0.38
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
NPSR1 Q6W5P4 2/20 0.37
CYP2C19 P33261 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
SCHEMBL15955672 0.83 ALDH1A1 (0.48) RHEBMAPTALDH1A1MAPK1PDE7A
SCHEMBL5982030 0.82 CYP3A4 (0.55) RHEBMAPTALDH1A1MAPK1L3MBTL1
SCHEMBL15955533 0.79 ALDH1A1 (0.37) RHEBMAPTALDH1A1MAPK1L3MBTL1
SCHEMBL15955627 0.79 PTGIR (0.49) RHEBMAPTALDH1A1MAPK1TDP1
SCHEMBL15955856 0.79 CYP3A4 (0.42) RHEBMAPTALDH1A1MAPK1PDE7A
SCHEMBL20132264 0.78 TSHR (0.43) MAPTALDH1A1MAPK1L3MBTL1PDE7A
SCHEMBL15955901 0.78 PKM (0.43) ALDH1A1PDE7AHPGDTDP1CYP3A4
SCHEMBL19540473 0.78 MLYCD (0.48) MAPTALDH1A1MAPK1L3MBTL1HPGD
SCHEMBL83853 0.75 ACHE (0.57) MAPTALDH1A1MAPK1L3MBTL1HPGD
SCHEMBL12245875 0.75 ACHE (0.57) MAPTALDH1A1MAPK1L3MBTL1HPGD

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
WO-2014126580-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2014-08-21 WO disclosed
WO-2014126580-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2014-08-21 WO disclosed