SCHEMBL9536061

SCHEMBL9536061

Cc1cc(-c2cccc(Cl)c2)n2nc(S)nc2n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.51
ALDH1A1 P00352 5/20 0.51
HPGD P15428 4/20 0.51
HSD17B10 Q99714 2/20 0.51
MAPK1 P28482 2/20 0.51
SMN1; SMN2 Q16637 3/20 0.44
DYRK3 O43781 1/20 0.43
CCNT1 O60563 1/20 0.43
CCNA2 P20248 1/20 0.43
CDK2 P24941 1/20 0.43
CDK9 P50750 1/20 0.43
CDK5 Q00535 1/20 0.43
DYRK1A Q13627 1/20 0.43
CDK5R1 Q15078 1/20 0.43
DYRK2 Q92630 1/20 0.43
DYRK1B Q9Y463 1/20 0.43
MAPT P10636 1/20 0.42
GAA P10253 1/20 0.41
PDE10A Q9Y233 1/20 0.41
TP53 P04637 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
SCHEMBL9538048 0.85 KDM4E (0.52) KDM4EALDH1A1HPGDHSD17B10MAPK1
SCHEMBL9534983 0.84 KDM4E (0.68) KDM4EALDH1A1HPGDHSD17B10MAPK1
SCHEMBL9535645 0.81 KDM4E (0.48) KDM4EALDH1A1HPGDHSD17B10MAPK1
SCHEMBL9538733 0.78 KDM4E (0.54) KDM4EALDH1A1HPGDHSD17B10MAPK1
SCHEMBL9537071 0.73 KDM4E (0.68) KDM4EALDH1A1HPGDHSD17B10MAPK1
SCHEMBL18499244 0.70 KDM4E (0.74) KDM4EALDH1A1HPGDHSD17B10MAPK1
SCHEMBL257330 0.69 DYRK3 (0.51) MAPK1SMN1; SMN2DYRK3CCNT1CCNA2
SCHEMBL462684 0.69 MAPT (0.79) KDM4EALDH1A1HPGDHSD17B10MAPK1
SCHEMBL9869931 0.69 KDM4E (0.75) KDM4EALDH1A1HPGDHSD17B10MAPK1
SCHEMBL2488614 0.69 RECQL (0.61) KDM4EALDH1A1HPGDHSD17B10SMN1; SMN2

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
EP-0353902-B1 SUBSTITUTED PHENYLTRIAZOLOPYRIMIDINE HERBICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-05-05 EP disclosed
US-5127936-A Substituted phenyltriazolopyrimidine herbicides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-07-07 US disclosed
WO-1990012012-A1 SUBSTITUTED PHENYLTRIAZOLOPYRIMIDINE HERBICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1990-10-18 WO disclosed
EP-0353902-A1 Substituted phenyltriazolopyrimidine herbicides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1990-02-07 EP disclosed