SCHEMBL3515072

SCHEMBL3515072

CC(Nc1cncc(Cl)n1)c1ccc(F)cc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AURKA O14965 1/20 0.52
AURKB Q96GD4 1/20 0.52
CCNT1 O60563 1/20 0.49
CDK9 P50750 1/20 0.49
GPR55 Q9Y2T6 7/20 0.49
CSF1R P07333 10/20 0.48
RET P07949 1/20 0.46
PDGFRB P09619 1/20 0.46
KIT P10721 1/20 0.46
SRC P12931 1/20 0.46
PDGFRA P16234 1/20 0.46
FLT1 P17948 1/20 0.46
FLT4 P35916 1/20 0.46
KDR P35968 1/20 0.46
FRK P42685 1/20 0.46
DDR1 Q08345 1/20 0.46
NTRK1 P04629 1/20 0.45

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
SCHEMBL13313087 1.00 AURKA (0.52) AURKAAURKBCCNT1CDK9GPR55
SCHEMBL3557473 1.00 AURKA (0.52) AURKAAURKBCCNT1CDK9GPR55
SCHEMBL1679263 0.86 CSF1R (0.59) AURKAAURKBCCNT1CDK9GPR55
SCHEMBL14705857 0.85 CSF1R (0.48) AURKAAURKBCSF1RRETPDGFRB
SCHEMBL13478835 0.85 CSF1R (0.48) AURKAAURKBCCNT1CDK9CSF1R
SCHEMBL6528042 0.85 CSF1R (0.53) AURKAAURKBCCNT1CDK9CSF1R
SCHEMBL3149272 0.85 CSF1R (0.53) AURKAAURKBCCNT1CDK9CSF1R
SCHEMBL1678955 0.84 CSF1R (0.62) CCNT1CDK9CSF1RRETPDGFRB
SCHEMBL1679576 0.84 CSF1R (0.62) CCNT1CDK9CSF1RRETPDGFRB
SCHEMBL1991252 0.84 CSF1R (0.62) CCNT1CDK9CSF1RRETPDGFRB

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
EP-1689739-B1 AZOLE-BASED KINASE INHIBITORS YM BIOSCIENCES AUSTRALIA PTY (AU) 2016-03-30 EP disclosed
US-20100331315-A1 RHODANINES AND RELATED HETEROCYCLES AS KINASE INHIBITORS SENHWA BIOSCIENCES, INC. (TW) 2010-12-30 US disclosed
US-20100331315-A1 RHODANINES AND RELATED HETEROCYCLES AS KINASE INHIBITORS SENHWA BIOSCIENCES, INC. (TW) 2010-12-30 US disclosed
US-20100331315-A1 RHODANINES AND RELATED HETEROCYCLES AS KINASE INHIBITORS SENHWA BIOSCIENCES, INC. (TW) 2010-12-30 US disclosed
WO-2010148351-A1 RHODANINES AND RELATED HETEROCYCLES AS KINASE INHIBITORS CYLENE PHARMACEUTICALS, INC. (US) 2010-12-23 WO disclosed
US-7737143-B2 Substituted pyrazines as kinase inhibitors YM BIOSCIENCES AUSTRALIA PTY LTD (AU) 2010-06-15 US disclosed
US-7737143-B2 Substituted pyrazines as kinase inhibitors YM BIOSCIENCES AUSTRALIA PTY LTD (AU) 2010-06-15 US disclosed
US-7737143-B2 Substituted pyrazines as kinase inhibitors YM BIOSCIENCES AUSTRALIA PTY LTD (AU) 2010-06-15 US disclosed
US-20070099935-A1 such as 6-(1H-Benzimidazol-1-yl)-N-benzylpyrazin-2-amine, used as antidiabetic, anticarcinogenic and antiarthritic agents or for treating autoimmune diseases YM BIOSCIENCES AUSTRALIA PTY LTD (AU) 2007-05-03 US disclosed
US-20070099935-A1 such as 6-(1H-Benzimidazol-1-yl)-N-benzylpyrazin-2-amine, used as antidiabetic, anticarcinogenic and antiarthritic agents or for treating autoimmune diseases YM BIOSCIENCES AUSTRALIA PTY LTD (AU) 2007-05-03 US disclosed
US-20070099935-A1 such as 6-(1H-Benzimidazol-1-yl)-N-benzylpyrazin-2-amine, used as antidiabetic, anticarcinogenic and antiarthritic agents or for treating autoimmune diseases YM BIOSCIENCES AUSTRALIA PTY LTD (AU) 2007-05-03 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-20070099935-A1 such as 6-(1H-Benzimidazol-1-yl)-N-benzylpyrazin-2-amine, used as antidiabetic, anticarcinogenic and antiarthritic agents or for treating autoimmune diseases PRKACA, MAP3K6, PRKDC AURKA 486/4885AURKB 837/4885CCNT1 809/4885
US-20100331315-A1 RHODANINES AND RELATED HETEROCYCLES AS KINASE INHIBITORS PIM2, PIM1, CDK2 AURKA 390/4885AURKB 426/4885CCNT1 234/4885

“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.