SCHEMBL16112643

SCHEMBL16112643

CCc1c(C)cccc1NC(=S)NC(=O)c1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.72
NPC1 O15118 3/20 0.61
RAB9A P51151 3/20 0.61
NPSR1 Q6W5P4 2/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
ALDH1A1 P00352 8/20 0.57
MAPT P10636 4/20 0.57
RXFP1 Q9HBX9 1/20 0.57
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
ALOX12 P18054 2/20 0.56
TDP1 Q9NUW8 1/20 0.56
KDM4E B2RXH2 3/20 0.55
HPGD P15428 1/20 0.55
POLB P06746 2/20 0.54
LMNA P02545 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53

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
SCHEMBL5713527 0.84 EPHX1 (1.00) EPHX1NPC1RAB9ANPSR1L3MBTL1
SCHEMBL11171600 0.82 EPHX1 (0.68) EPHX1NPC1RAB9ANPSR1L3MBTL1
SCHEMBL8612464 0.82 EPHX1 (0.77) EPHX1NPC1RAB9ANPSR1L3MBTL1
SCHEMBL16119713 0.82 EPHX1 (0.72) EPHX1NPC1RAB9ANPSR1L3MBTL1
SCHEMBL9686610 0.81 EPHX1 (0.76) EPHX1NPC1RAB9ANPSR1L3MBTL1
SCHEMBL31389407 0.81 EPHX1 (0.76) EPHX1NPC1RAB9ANPSR1L3MBTL1
SCHEMBL16030042 0.80 ALDH1A1 (0.62) EPHX1NPC1RAB9AALDH1A1MAPT
SCHEMBL6118209 0.80 EPHX1 (0.78) EPHX1NPC1RAB9ANPSR1L3MBTL1
SCHEMBL11171176 0.80 EPHX1 (0.78) EPHX1NPC1RAB9ANPSR1L3MBTL1
SCHEMBL14577329 0.79 EPHX1 (0.72) EPHX1NPC1RAB9ANPSR1L3MBTL1

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-2970176-A1 MOLECULES HAVING CERTAIN PESTICIDAL UTILITIES, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES RELATED THERETO Dow AgroSciences LLC (US) 2016-01-20 EP disclosed
WO-2014160031-A1 MOLECULES HAVING CERTAIN PESTICIDAL UTILITIES, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2014-10-02 WO disclosed