SCHEMBL11615640

SCHEMBL11615640

Cn1c(=O)n(-c2cc(Cl)cc(Cl)c2)c(=O)n1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 2/20 0.52
GSK3B P49841 2/20 0.52
TSHR P16473 2/20 0.44
KDM4E B2RXH2 1/20 0.41
NOTUM Q6P988 1/20 0.40
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.36
BCL2A1 Q16548 1/20 0.36
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
ADRB1 P08588 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
HSD17B10 Q99714 1/20 0.34
ELANE P08246 1/20 0.33
BRD9 Q9H8M2 1/20 0.33
ADORA2A P29274 1/20 0.32
DRD2 P14416 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
SCHEMBL11618507 0.86 GSK3A (0.39) GSK3AGSK3BTSHRKDM4ENOTUM
SCHEMBL11614680 0.82 GSK3A (0.37) GSK3AGSK3BTSHRKDM4ENOTUM
SCHEMBL11617467 0.82 GSK3A (0.37) GSK3AGSK3BTSHRKDM4ENOTUM
SCHEMBL11615826 0.81 NOTUM (0.39) GSK3AGSK3BTSHRKDM4ENOTUM
SCHEMBL11613597 0.80 GSK3A (0.56) GSK3AGSK3BTSHRALDH1A1POLB
SCHEMBL6219762 0.73 GAA (0.50) GSK3AGSK3BTSHRKDM4ENOTUM
SCHEMBL11369101 0.73 ALDH1A1 (0.61) TSHRKDM4ENOTUMALDH1A1POLB
SCHEMBL11364283 0.73 ALDH1A1 (0.67) TSHRKDM4ENOTUMALDH1A1POLB
SCHEMBL11571271 0.73 ALDH1A1 (0.43) TSHRKDM4ENOTUMALDH1A1POLB
SCHEMBL11612676 0.73 KDM4E (0.39) GSK3AGSK3BTSHRKDM4ENOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4088767-A 4-Dichlorophenylurazole compounds and use in agricultural fungicidal compositions MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JA) 1978-05-09 US claimed
JP-52083562-A None JP disclosed
US-4088767-A 4-Dichlorophenylurazole compounds and use in agricultural fungicidal compositions MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JA) 1978-05-09 US disclosed
JP-S5283562-A 1,2-SUBSTITUTED-4- (3,5-DICHLOROPHENYL) URAZOLE MITSUBISHI CHEM IND LTD 1977-07-12 JP disclosed