SCHEMBL8615570

SCHEMBL8615570

Fc1ccc(-c2ccncn2)c(F)c1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPL P40238 1/20 0.41
MAPK9 P45984 4/20 0.41
EGFR P00533 4/20 0.41
MAP4K4 O95819 3/20 0.41
FRK P42685 3/20 0.41
CSNK1A1 P48729 2/20 0.41
MAPK10 P53779 2/20 0.40
MAPK14 Q16539 2/20 0.40
CYP2D6 P10635 1/20 0.37
CCNT1 O60563 2/20 0.36
CCNA2 P20248 2/20 0.36
CDK2 P24941 2/20 0.36
CDK9 P50750 2/20 0.36
CCNA1 P78396 2/20 0.36
CDK5 Q00535 2/20 0.36
CDK5R1 Q15078 2/20 0.36
MAPK11 Q15759 1/20 0.36
CASP6 P55212 1/20 0.35
ROCK2 O75116 1/20 0.35
ROCK1 Q13464 1/20 0.35

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
Hydrochloric Acid SCHEMBL8616874 0.98 MPL (0.40) MPLMAPK9EGFRMAP4K4FRK
SCHEMBL1877363 0.76 MAPK14 (0.62) MPLMAPK9EGFRMAP4K4FRK
SCHEMBL25184191 0.76 MAPK9 (0.47) MAPK9EGFRMAP4K4FRKCSNK1A1
SCHEMBL1444770 0.76 KMO (0.51) MPLMAPK9EGFRMAP4K4FRK
SCHEMBL28296072 0.74 NPC1 (0.46) MPLMAPK9EGFRMAP4K4FRK
SCHEMBL1444789 0.74 EGFR (0.42) MAPK9EGFRMAP4K4FRKCSNK1A1
SCHEMBL30141958 0.74 NPC1 (0.46) MPLMAPK9EGFRMAP4K4FRK
SCHEMBL29901541 0.74 KDM4E (0.50) MAPK14HSP90AA1
SCHEMBL1356335 0.74 KDM4E (0.50) MAPK14HSP90AA1
SCHEMBL27752919 0.73 ALOX5AP (0.44) CYP2D6CASP6ROCK2ROCK1CDC42BPB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101193884-A Tubulin inhibitor and process for its preparation WYETH CORP (US) 2008-06-04 CN claimed
CN-100445269-C 2-substituted pyrimidines BASF AG (DE) 2008-12-24 CN disclosed
CN-101268059-A 2-substituted hydroxylaminopyrimidine, method for the production and the use thereof in the form of pesticides BASF SE (DE) 2008-09-17 CN disclosed
CN-101139349-A Heterobicyclic compounds used as fungicides BASF AG (DE) 2008-03-12 CN disclosed
CN-100358896-C Heterobicyclic compounds useful as fungicides BASF AG (DE) 2008-01-02 CN disclosed
CN-100357297-C Pyrimidines, method for the production thereof and use thereof BASF AG (DE) 2007-12-26 CN disclosed
CN-1984902-A 2-substituted pyrimidines, method for the production thereof and use thereof for controlling pathogenic fungi BASF AG (DE) 2007-06-20 CN disclosed
CN-1871009-A 5-arylpyrimidines as anticancer agents WYETH CORP (US) 2006-11-29 CN disclosed
CN-1774439-A Heterobicyclic compounds useful as fungicides BASF AG (DE) 2006-05-17 CN disclosed
CN-1768045-A 2-substituted pyrimidines BASF AG (DE) 2006-05-03 CN disclosed
CN-1747958-A Pyrimidines, methods for the production thereof, and use thereof BASF AG (DE) 2006-03-15 CN disclosed
WO-1998051311-A2 DIHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1998-11-19 WO disclosed
CN-1069490-A Urea derivatives YAMANOUCHI PHARMA CO LTD (JP) 1993-03-03 CN disclosed