SCHEMBL4173092

SCHEMBL4173092

Cc1cc2[nH]c(Nc3ccc(Oc4cccnc4)cc3)nc2cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 3/20 0.48
CSNK1A1 P48729 2/20 0.48
KDR P35968 5/20 0.47
PDE10A Q9Y233 4/20 0.47
RAF1 P04049 4/20 0.44
CDK1 P06493 2/20 0.43
ALDH1A1 P00352 1/20 0.42
HTT P42858 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CSNK1G2 P78368 2/20 0.41
TTBK1 Q5TCY1 1/20 0.41
TTBK2 Q6IQ55 1/20 0.41
GSK3B P49841 1/20 0.40
BRAF P15056 3/20 0.40
CHEK2 O96017 1/20 0.40

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
SCHEMBL4173611 0.91 CSNK1D (0.52) CSNK1DCSNK1A1KDRPDE10ARAF1
SCHEMBL4164725 0.91 CSNK1A1 (0.52) CSNK1DCSNK1A1KDRPDE10ARAF1
SCHEMBL4170820 0.88 KDR (0.59) CSNK1DCSNK1A1KDRPDE10ARAF1
SCHEMBL4169753 0.85 KDR (0.61) CSNK1DCSNK1A1KDRPDE10ARAF1
SCHEMBL4164550 0.84 CSNK1A1 (0.59) CSNK1DCSNK1A1KDRPDE10ARAF1
SCHEMBL4170478 0.84 PDE10A (0.52) CSNK1DCSNK1A1KDRPDE10ARAF1
SCHEMBL4173628 0.80 PDE10A (0.43) CSNK1DCSNK1A1KDRPDE10ARAF1
SCHEMBL4164763 0.79 KDR (0.54) CSNK1DCSNK1A1KDRPDE10ARAF1
SCHEMBL4164559 0.79 KDR (0.63) CSNK1DCSNK1A1KDRPDE10ARAF1
SCHEMBL4170611 0.78 PDE10A (0.48) CSNK1DCSNK1A1KDRPDE10ACDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090082404-A1 BENZIMIDAZOLES MERCK PATENT GMBH (DE) 2009-03-26 US claimed
US-20070066660-A1 Benzimidazolyl derivatives MERCK PATENT GMBH (DE) 2007-03-22 US claimed
US-20090082404-A1 BENZIMIDAZOLES MERCK PATENT GMBH (DE) 2009-03-26 US disclosed
US-20090082404-A1 BENZIMIDAZOLES MERCK PATENT GMBH (DE) 2009-03-26 US disclosed
US-20090082404-A1 BENZIMIDAZOLES MERCK PATENT GMBH (DE) 2009-03-26 US disclosed
US-7470702-B2 Benzimidazoles MERCK PATENT GMBH (DE) 2008-12-30 US disclosed
US-7470702-B2 Benzimidazoles MERCK PATENT GMBH (DE) 2008-12-30 US disclosed
US-7470702-B2 Benzimidazoles MERCK PATENT GMBH (DE) 2008-12-30 US disclosed
US-20070066660-A1 Benzimidazolyl derivatives MERCK PATENT GMBH (DE) 2007-03-22 US disclosed
US-20070066660-A1 Benzimidazolyl derivatives MERCK PATENT GMBH (DE) 2007-03-22 US disclosed
US-20070066660-A1 Benzimidazolyl derivatives MERCK PATENT GMBH (DE) 2007-03-22 US 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 (2 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-20090082404-A1 BENZIMIDAZOLES TIE1, KDR, FLT1 CSNK1D 1595/4885CSNK1A1 2182/4885KDR 2/4885
US-20070066660-A1 Benzimidazolyl derivatives TIE1, ECE2, ABL1 CSNK1D 1710/4885CSNK1A1 2047/4885KDR 5/4885

“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.