SCHEMBL2286172

SCHEMBL2286172

CC(=O)c1cccc(Nc2nccc(-c3sc(-c4ccccc4)nc3C)n2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 12/20 0.55
CDK4 P11802 8/20 0.55
CCNT1 O60563 4/20 0.55
CCNA2 P20248 4/20 0.55
CDK9 P50750 4/20 0.55
CDK1 P06493 3/20 0.55
CCNB1 P14635 3/20 0.55
CDK7 P50613 3/20 0.55
CCNH P51946 3/20 0.55
ABL1 P00519 3/20 0.53
BCR P11274 3/20 0.53
PRKCA P17252 2/20 0.53
SRC P12931 2/20 0.52
PRKD3 O94806 1/20 0.52
PRKCG P05129 1/20 0.52
PRKCB P05771 1/20 0.52
PDGFRB P09619 1/20 0.52
PDGFRA P16234 1/20 0.52
PRKCH P24723 1/20 0.52
PRKCI P41743 1/20 0.52

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
SCHEMBL2290834 0.85 CDK2 (0.74) CDK2CDK4CCNA2CDK9CDK1
SCHEMBL2286799 0.84 CDK2 (0.74) CDK2CDK4CCNT1CCNA2CDK9
SCHEMBL2286543 0.82 PIK3CG (0.61) CDK2CDK4CCNT1CCNA2CDK9
SCHEMBL5781584 0.82 CCNT1 (0.54) CDK2CDK4CCNT1CCNA2CDK9
SCHEMBL2288580 0.82 CDK2 (0.77) CDK2CDK4CCNT1CCNA2CDK9
SCHEMBL6363180 0.80 CDK2 (0.71) CDK2CDK4CCNT1CCNA2CDK9
SCHEMBL2286448 0.80 CDK2 (0.59) CDK2CDK4CCNT1CCNA2CDK9
SCHEMBL6362401 0.80 CDK2 (0.57) CDK2CDK4CCNA2CDK9CDK1
SCHEMBL14216060 0.79 SRC (0.64) CDK2CDK4CCNT1CCNA2CDK9
SCHEMBL2289382 0.79 CDK2 (0.56) CDK2CDK4CCNA2CDK9CDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110195968-A1 THIAZOLES AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2011-08-11 US disclosed
US-20090030024-A1 THIAZOLES AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2009-01-29 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-20090030024-A1 THIAZOLES AS FUNGICIDES CYP4X1, CYP4Z1, RDX CDK2 2065/4885CDK4 776/4885CCNT1 513/4885
US-20110195968-A1 THIAZOLES AS FUNGICIDES CYP4X1, CYP4Z1, CYP3A4 CDK2 2144/4885CDK4 818/4885CCNT1 528/4885

“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.