SCHEMBL625879

SCHEMBL625879

c1ccc(ONc2csnn2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KMT2A Q03164 5/20 0.39
MEN1 O00255 4/20 0.39
RAB9A P51151 4/20 0.39
NPC1 O15118 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
POLB P06746 1/20 0.36
MAPT P10636 4/20 0.36
KDM4E B2RXH2 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
HPGD P15428 1/20 0.35
CYP2C19 P33261 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
CDK5 Q00535 2/20 0.33
CDK5R1 Q15078 2/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL2840428 0.71 KMT2A (0.48) ALDH1A1ATML3MBTL1KMT2AMEN1
SCHEMBL1421293 0.67 MEN1 (0.47) ALDH1A1L3MBTL1KMT2AMEN1RAB9A
SCHEMBL18171558 0.67 LTA4H (0.30) LTA4HTSHR
SCHEMBL11428118 0.67 FABP1 (0.50) ALDH1A1L3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL1790430 0.65 LTA4H (0.50) ALDH1A1L3MBTL1KDM4ETDP1LTA4H
SCHEMBL9666195 0.64 ALDH1A1 (0.67) ALDH1A1ATML3MBTL1KMT2AMEN1
SCHEMBL251644 0.64 ALDH1A1 (0.43) ALDH1A1L3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL15689353 0.63 KMT2A (0.52) L3MBTL1KMT2AMEN1RAB9ANPC1
SCHEMBL2121426 0.62 LTA4H (0.47) ALDH1A1L3MBTL1KDM4ETDP1LTA4H
SCHEMBL21328562 0.62 LTA4H (0.47) ALDH1A1L3MBTL1KDM4ETDP1LTA4H

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2307390-B1 THIADIAZOLYLOXYPHENYLAMIDINES AND USE THEREOF AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2014-01-22 EP claimed
EP-2307391-B1 THIADIAZOLYLOXYPHENYLAMIDINES AND USE THEREOF AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2014-01-01 EP claimed
WO-2012019998-A1 PRODUCTION OF N'-(4-{[3-(4-CHLORBENZYL)-1,2,4-THIADIAZOL-5-YL] OXY} -2,5-DIMETHYLPHENYL)-N-ETHYL-N-METHYLIMIDOFORMAMIDE BAYER CROPSCIENCE AG (DE) 2012-02-16 WO claimed
EP-2307390-A2 THIADIAZOLYLOXYPHENYLAMIDINES AND USE THEREOF AS FUNGICIDES Bayer CropScience AG (DE) 2011-04-13 EP claimed
EP-2307391-A2 THIADIAZOLYLOXYPHENYLAMIDINES AND USE THEREOF AS FUNGICIDES Bayer CropScience AG (DE) 2011-04-13 EP claimed
EP-2225218-A1 THIAZOLYLOXYPHENYLAMIDINES OR THIADIAZOLYLOXYPHENYLAMIDINES AND THEIR USE AS FUNGICIDES Bayer CropScience Aktiengesellschaft (DE) 2010-09-08 EP claimed
WO-2009156098-A2 THIADIAZOLYLOXYPHENYLAMIDINES AND USE THEREOF AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2009-12-30 WO claimed
WO-2009156074-A2 THIADIAZOLYLOXYPHENYLAMIDINES AND USE THEREOF AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2009-12-30 WO claimed
WO-2009083105-A1 THIAZOLYLOXYPHENYLAMIDINES OR THIADIAZOLYLOXYPHENYLAMIDINES AND THEIR USE AS FUNGICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2009-07-09 WO claimed
EP-2072506-A1 Thiazolyloxyphenylamidine or thiadiazolyloxyphenylamidine und its use as fungicide Bayer CropScience AG (DE) 2009-06-24 EP claimed
EP-2225218-A1 THIAZOLYLOXYPHENYLAMIDINES OR THIADIAZOLYLOXYPHENYLAMIDINES AND THEIR USE AS FUNGICIDES Bayer CropScience Aktiengesellschaft (DE) 2010-09-08 EP disclosed
WO-2009083105-A1 THIAZOLYLOXYPHENYLAMIDINES OR THIADIAZOLYLOXYPHENYLAMIDINES AND THEIR USE AS FUNGICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2009-07-09 WO disclosed
EP-2072506-A1 Thiazolyloxyphenylamidine or thiadiazolyloxyphenylamidine und its use as fungicide Bayer CropScience AG (DE) 2009-06-24 EP disclosed
EP-2072506-A1 Thiazolyloxyphenylamidine or thiadiazolyloxyphenylamidine und its use as fungicide Bayer CropScience AG (DE) 2009-06-24 EP disclosed