SCHEMBL7843693

SCHEMBL7843693

CSc1ncc(Br)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.42
KMT2A Q03164 3/20 0.34
HTT P42858 1/20 0.34
S1PR1 P21453 1/20 0.33
S1PR3 Q99500 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
PKM P14618 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32
MET P08581 1/20 0.32
GABRP O00591 1/20 0.32
GABRD O14764 1/20 0.32
GABRA1 P14867 1/20 0.32
GABRB1 P18505 1/20 0.32
GABRG2 P18507 1/20 0.32
GABRB3 P28472 1/20 0.32
GABRA5 P31644 1/20 0.32
GABRA3 P34903 1/20 0.32

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
SCHEMBL15053158 0.77 S1PR1 (0.37) KMT2AHTTS1PR1S1PR3KDM4E
SCHEMBL15052654 0.75 HTT (0.34) KMT2AHTTALDH1A1METDYRK1A
SCHEMBL6041535 0.72 HTT (0.32) KMT2AHTTHSD17B10SMN1; SMN2
SCHEMBL14558313 0.72 NFKB1 (0.33)
SCHEMBL15052497 0.72 RAB9A (0.38) KMT2AHTTALDH1A1MAPTSMN1; SMN2
SCHEMBL7993729 0.72 MEN1 (0.32) KMT2AKDM4EALDH1A1SMN1; SMN2MEN1
SCHEMBL2067135 0.71
SCHEMBL28862798 0.71 PLAU (0.42) PLAUKMT2AHTTALDH1A1LMNA
SCHEMBL29928843 0.71 PLAU (0.42) PLAUKMT2AHTTALDH1A1LMNA
SCHEMBL18179659 0.71 PLAU (0.42) PLAUKMT2AHTTS1PR1S1PR3

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
EP-1114045-A1 2-METHOXYIMINO-2-(PYRIDINYLOXYMETHYL)PHENYL ACETAMIDES WITH 5 MEMBERED HETEROCYCLIC RINGS ON THE PYRIDINE RING AS FUNGICIDES Dow AgroSciences LLC (US) 2001-07-11 EP disclosed
US-6133294-A APPLYING AS FUNGICIDES DOW AGROSCIENCES LLC 2000-10-17 US disclosed
WO-2000015637-A1 2-METHOXYIMINO -2-(PYRIDINYLOXYMETHYL) PHENYL ACETAMIDES WITH 5 MEMBERED HETEROCYCLIC RINGS ON THE PYRIDINE RING AS FUNGICIDES DOW AGROSCIENCES LLC (US) 2000-03-23 WO disclosed