SCHEMBL9517014

SCHEMBL9517014

CSc1ncc2ccccn12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.50
KDM4E B2RXH2 10/20 0.50
MAPT P10636 6/20 0.50
CHEK1 O14757 1/20 0.50
LIMK1 P53667 1/20 0.50
MAPK14 Q16539 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
RAB9A P51151 6/20 0.48
HPGD P15428 5/20 0.46
HSD17B10 Q99714 3/20 0.46
GLA P06280 1/20 0.46
GAA P10253 1/20 0.46
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
NPC1 O15118 3/20 0.45
MAPK1 P28482 2/20 0.45
POLB P06746 2/20 0.44
GFER P55789 1/20 0.41

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
SCHEMBL3530937 0.80 ALDH1A1 (0.54) ALDH1A1KDM4EMAPTCHEK1LIMK1
SCHEMBL30214863 0.76 ALDH1A1 (0.37) ALDH1A1KDM4EMAPTCHEK1LIMK1
SCHEMBL6840370 0.74 ALDH1A1 (0.60) ALDH1A1KDM4EMAPTCHEK1LIMK1
SCHEMBL11180589 0.73 ALDH1A1 (0.48) ALDH1A1KDM4EMAPTCHEK1LIMK1
SCHEMBL24128052 0.70 MAPK1 (0.40) ALDH1A1KDM4EMAPTTDP1RAB9A
SCHEMBL14738238 0.70 MEN1 (0.39) ALDH1A1MAPK14MEN1KMT2APOLB
SCHEMBL3538954 0.69 KDM4E (0.55) ALDH1A1KDM4EMAPTCHEK1LIMK1
SCHEMBL10207538 0.69 KDM4E (0.58) ALDH1A1KDM4EMAPTCHEK1LIMK1
SCHEMBL20674503 0.69 KDM4E (0.55) ALDH1A1KDM4EMAPTCHEK1LIMK1
SCHEMBL23246964 0.69 KDM4E (0.55) ALDH1A1KDM4EMAPTCHEK1LIMK1

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-0238070-B1 Sulfonylurea compounds, their production and herbicidal use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1993-12-29 EP disclosed
US-5017212-A For rice paddies TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1991-05-21 US disclosed
EP-0238070-A2 Sulfonylurea compounds, their production and herbicidal use Takeda Chemical Industries, Ltd. (JP) 1987-09-23 EP disclosed