SCHEMBL9618858

SCHEMBL9618858

N#CSc1nc(I)ncc1Cl

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.31
WDR5 P61964 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL9618882 0.81 MYC (0.32) MYCWDR5
SCHEMBL9618980 0.81 CSNK1A1 (0.40) MYCWDR5KDM4EALDH1A1POLB
SCHEMBL9618754 0.78 RPS6KA5 (0.31) MYCWDR5KDM4EALDH1A1POLB
SCHEMBL9618787 0.78 MYC (0.31) MYCWDR5
SCHEMBL9618795 0.78 RPS6KA5 (0.31) MYCWDR5KDM4EALDH1A1POLB
SCHEMBL9618841 0.78 MYC (0.31) MYCWDR5
SCHEMBL13805714 0.74
SCHEMBL9618904 0.70 CSNK1A1 (0.38) MYCWDR5
SCHEMBL9618921 0.66
SCHEMBL9618767 0.63 CSNK1A1 (0.38) MYCWDR5ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0244193-B1 DIHALOGEN-SUBSTITUTED THIOCYANOPYRIMIDINE DERIVATIVES MITSUI TOATSU CHEMICALS, Inc. (JP) 1992-01-08 EP claimed
EP-0244193-A2 Dihalogen-substituted thiocyanopyrimidine derivatives MITSUI TOATSU CHEMICALS, Inc. (JP) 1987-11-04 EP claimed
EP-0244193-B1 DIHALOGEN-SUBSTITUTED THIOCYANOPYRIMIDINE DERIVATIVES MITSUI TOATSU CHEMICALS, Inc. (JP) 1992-01-08 EP disclosed
US-4814337-A Dihalogen-substituted thiocyanopyrimidine derivatives, and agricultural and horticultural fungicidal compositions containing same MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1989-03-21 US disclosed
EP-0244193-A2 Dihalogen-substituted thiocyanopyrimidine derivatives MITSUI TOATSU CHEMICALS, Inc. (JP) 1987-11-04 EP disclosed