SCHEMBL9019845

SCHEMBL9019845

CSc1nc(Cl)cc(OC(F)F)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.40
KMT2A Q03164 7/20 0.39
MEN1 O00255 5/20 0.38
GAA P10253 3/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HTT P42858 3/20 0.37
THRB P10828 1/20 0.34
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 1/20 0.33
ADORA3 P0DMS8 2/20 0.32
ADORA2A P29274 2/20 0.32
TSHR P16473 3/20 0.31
LMNA P02545 2/20 0.31
NPSR1 Q6W5P4 1/20 0.31
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
RXRG P48443 1/20 0.31
PPARA Q07869 1/20 0.31
F2RL3 Q96RI0 1/20 0.31
MAPT P10636 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
SCHEMBL7586002 0.87 KMT2A (0.39) KMT2AMEN1GAAHTTTHRB
SCHEMBL23908020 0.84 POLB (0.41) POLBKMT2AMEN1GAASMN1; SMN2
SCHEMBL10653981 0.81 KMT2A (0.53) POLBKMT2AMEN1GAAHTT
SCHEMBL9019828 0.79 KMT2A (0.41) KMT2AMEN1GAAHTTTHRB
SCHEMBL991954 0.78 POLB (0.44) POLBKMT2AMEN1GAASMN1; SMN2
SCHEMBL25231249 0.77 F2RL3 (0.35) KMT2AMEN1GAAHTTALDH1A1
SCHEMBL9657230 0.75 ALDH1A1 (0.31) KMT2AMEN1HTTTHRBALDH1A1
SCHEMBL62021 0.74 POLB (0.53) POLBKMT2AMEN1GAASMN1; SMN2
SCHEMBL2387324 0.74 ADORA3 (0.48) POLBKMT2AMEN1GAASMN1; SMN2
SCHEMBL16044834 0.73 KMT2A (0.45) POLBKMT2AMEN1GAASMN1; 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0468069-B1 Process for producing a 4,6-bis(difluoromethoxy)-2-alkylthiopyrimidine ASAHI GLASS CO LTD (JP) 1996-10-02 EP disclosed
EP-0244359-B1 PROCESS FOR THE PREPARATION OF PYRIMIDINE DERIVATIVES CIBA-GEIGY AG (CH) 1992-07-22 EP disclosed
EP-0468069-A1 Process for producing a 4,6-bis(difluoromethoxy)-2-alkylthiopyrimidine ASAHI GLASS COMPANY LTD. (JP) 1992-01-29 EP disclosed
US-5071982-A Process for producing a 4,6-bis(difluoromethoxy)-2-alkylthiopyrimidine ASAHI GLASS CO., LTD. (JP) 1991-12-10 US disclosed
EP-0244359-A2 Process for the preparation of pyrimidine derivatives CIBA-GEIGY AG (CH) 1987-11-04 EP disclosed
US-4692524-A HERBICIDE INTERMEDIATES CIBA-GEIGY CORPORATION (US) 1987-09-08 US disclosed