SCHEMBL2403389

SCHEMBL2403389

COCC(C)Nc1cc(-c2ccnc(Nc3ccnc(Cl)c3)n2)ccn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CAMK2D Q13557 12/20 0.52
▸ CDK2 P24941 4/20 0.47
▸ PIM1 P11309 2/20 0.47
▸ GSK3B P49841 2/20 0.47
▸ CDC7 O00311 1/20 0.47
▸ ROCK2 O75116 1/20 0.47
▸ MAP4K4 O95819 1/20 0.47
▸ PRKACA P17612 1/20 0.47
▸ HIPK2 Q9H2X6 1/20 0.47
▸ CLK4 Q9HAZ1 1/20 0.47
▸ IRAK4 Q9NWZ3 1/20 0.47
▸ MAPT P10636 2/20 0.46
▸ CSNK2A1 P68400 1/20 0.46
▸ CDK4 P11802 2/20 0.45
▸ CCNA2 P20248 2/20 0.45
▸ MTOR P42345 2/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ CCNT1 O60563 1/20 0.45
▸ CDK1 P06493 1/20 0.45
▸ CCNB1 P14635 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
SCHEMBL14581972 0.89 CAMK2D (0.56) CAMK2DCDK2PIM1GSK3BCDC7
SCHEMBL3476018 0.88 MAPT (0.47) CAMK2DCDK2PIM1GSK3BMAPT
SCHEMBL6107479 0.88 CSNK2A1 (0.62) CAMK2DCDK2MAPTCSNK2A1CDK4
SCHEMBL2390633 0.84 CDK2 (0.47) CDK2PIM1GSK3BCDC7ROCK2
SCHEMBL6106440 0.81 MAPT (0.55) CAMK2DCDK2PIM1GSK3BCDC7
SCHEMBL4029190 0.81 ROCK2 (0.53) CDK2PIM1GSK3BCDC7ROCK2
SCHEMBL2389030 0.80 CSNK2A1 (0.56) CAMK2DCDK2MAPTCSNK2A1CDK4
SCHEMBL2330123 0.78 PLK1 (0.56) CAMK2DCDK2PIM1GSK3BCLK4
SCHEMBL16496154 0.76 CAMK2D (0.54) CAMK2DCDK2CDC7MAPTCSNK2A1
SCHEMBL2388443 0.75 MAPK14 (0.41) CAMK2DCDK2PIM1GSK3BCDC7

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
US-20110237594-A1 FUNGICIDE HERETOCYCLYL-TRIAZINYL-AMINO DERIVATIVES BAYER CROPSCIENCE AG (DE) 2011-09-29 — — 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 (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-20110237594-A1 FUNGICIDE HERETOCYCLYL-TRIAZINYL-AMINO DERIVATIVES CYP4X1, RDX, PRXL2A CAMK2D 3941/4885CDK2 1085/4885PIM1 2730/4885

“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.

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