SCHEMBL3928879

SCHEMBL3928879

NC(=O)c1cn(C2CCCCO2)nc1-c1nc2cc(F)c(N3CCOCC3)cc2[nH]1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ATR Q13535 5/20 0.40
SYK P43405 2/20 0.36
FLT3 P36888 6/20 0.36
FGFR1 P11362 1/20 0.36
FGFR2 P21802 1/20 0.36
FGFR3 P22607 1/20 0.36
KDR P35968 1/20 0.36
PARP1 P09874 1/20 0.35
ALDH1A1 P00352 1/20 0.34
CHEK2 O96017 1/20 0.34
PDPK1 O15530 1/20 0.33
ABL1 P00519 1/20 0.33
ITK Q08881 1/20 0.33

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
SCHEMBL4124822 0.92 CSF1R (0.36) ATRFLT3FGFR1FGFR2FGFR3
SCHEMBL4129276 0.90 CSF1R (0.34) ATRFLT3FGFR1FGFR2FGFR3
SCHEMBL3924589 0.88 FGFR1 (0.38) ATRFLT3FGFR1FGFR2FGFR3
SCHEMBL3927246 0.85 FGFR1 (0.36) ATRFLT3FGFR1FGFR2FGFR3
SCHEMBL3937728 0.84 GCK (0.33) ATRFLT3FGFR1FGFR2FGFR3
SCHEMBL14311507 0.83 FGFR1 (0.35) ATRFLT3FGFR1FGFR2FGFR3
SCHEMBL3935076 0.82 ITK (0.37) FLT3FGFR1FGFR2FGFR3KDR
SCHEMBL4125135 0.82 MAPT (0.42) FGFR1FGFR2FGFR3KDRALDH1A1
SCHEMBL5952513 0.82 EGLN1 (0.37) ATRSYKPARP1CHEK2ABL1
SCHEMBL3924807 0.81 ATR (0.34) ATRFLT3FGFR1FGFR2FGFR3

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-2041119-B1 PYRAZOLYLBENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM AND USE THEREOF AVENTIS PHARMA SA (FR) 2017-05-10 EP disclosed
US-9126969-B2 Pyrazolylbenzimidazole derivatives, compositions containing them and use thereof AVENTIS PHARMA S.A. (FR) 2015-09-08 US disclosed
US-20090197866-A1 PYRAZOLYLBENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM AND USE THEREOF AVENTIS PHARMA S.A. (FR) 2009-08-06 US disclosed
EP-2041119-A1 PYRAZOLYLBENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM AND USE THEREOF Aventis Pharma S.A. (FR) 2009-04-01 EP disclosed
WO-2008003857-A1 PYRAZOLYLBENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM AND USE THEREOF AVENTIS PHARMA S.A. (FR) 2008-01-10 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090197866-A1 PYRAZOLYLBENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM AND USE THEREOF RB1, CCNI, CDK2 ATR 216/4885SYK 392/4885FLT3 30/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.