SCHEMBL4410380

SCHEMBL4410380

CCOc1ccc(F)c(NNc2c(F)ccc(OC)c2F)c1F

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TUBB1 Q9H4B7 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ PDE4D Q08499 5/20 0.37
▸ PDE4A P27815 4/20 0.37
▸ PDE4B Q07343 4/20 0.37
▸ PDE4C Q08493 4/20 0.37
▸ TSHR P16473 1/20 0.37
▸ MRGPRX4 Q96LA9 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ FGFR2 P21802 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ CALM1 P0DP23 2/20 0.36
▸ ATM Q13315 1/20 0.36
▸ PTGER2 P43116 1/20 0.35
▸ KDM1A O60341 2/20 0.35
▸ TP53 P04637 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
SCHEMBL16769037 0.84 KDM4E (0.52) TUBB1KDM4EGAAMAPTPDE4D
SCHEMBL4410377 0.79 KDM4E (0.50) TUBB1KDM4EGAAMAPTPDE4D
SCHEMBL11933107 0.77 KDM4E (0.46) TUBB1KDM4EGAAMAPTPDE4D
SCHEMBL24240291 0.76 L3MBTL1 (0.47) TUBB1KDM4EGAAMAPTL3MBTL1
SCHEMBL17527769 0.75 L3MBTL1 (0.48) TUBB1KDM4EGAAMAPTTSHR
SCHEMBL12093640 0.75 TUBB1 (0.49) TUBB1KDM4EGAAMAPTPDE4D
SCHEMBL9230265 0.74 TUBB1 (0.38) TUBB1GAAPDE4DMAPK1
SCHEMBL802723 0.71 HTR2A (0.44) TUBB1MAPK1KDM1A
SCHEMBL4405598 0.71 ALDH1A1 (0.45) TUBB1KDM4EGAAMAPTTSHR
SCHEMBL15682029 0.71 PDE4D (0.43) TUBB1KDM4EGAAMAPTPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1549651-B1 PYRIMIDOPYRIMIDONES AS KINASE INHIBITORS WARNER LAMBERT CO (US) 2009-12-23 — — EP disclosed
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