SCHEMBL2390628

SCHEMBL2390628

CSCC(C)Nc1nccc(-c2ccnc(Nc3cccc(Cl)c3)c2)n1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSNK2A1 P68400 2/20 0.57
▸ MAPT P10636 3/20 0.56
▸ CDK1 P06493 3/20 0.56
▸ MAPK1 P28482 3/20 0.56
▸ CDK2 P24941 3/20 0.56
▸ SMG1 Q96Q15 2/20 0.56
▸ NPC1 O15118 2/20 0.56
▸ XBP1 P17861 2/20 0.56
▸ HTT P42858 2/20 0.56
▸ RAB9A P51151 2/20 0.56
▸ CDK5 Q00535 2/20 0.56
▸ CDK5R1 Q15078 2/20 0.56
▸ CDK4 P11802 2/20 0.56
▸ CCNT1 O60563 1/20 0.56
▸ CCNB1 P14635 1/20 0.56
▸ CCNA2 P20248 1/20 0.56
▸ CCND1 P24385 1/20 0.56
▸ CCNE1 P24864 1/20 0.56
▸ MTOR P42345 1/20 0.56
▸ CDK7 P50613 1/20 0.56

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
SCHEMBL2387410 0.88 CAMK2D (0.52) CSNK2A1MAPTCDK1MAPK1CDK2
SCHEMBL2389030 0.87 CSNK2A1 (0.56) CSNK2A1MAPTCDK1MAPK1CDK2
SCHEMBL2388501 0.79 MAPK1 (0.42) MAPTMAPK1CDK2CDK4CCNA2
SCHEMBL6107479 0.79 CSNK2A1 (0.62) CSNK2A1MAPTCDK1MAPK1CDK2
SCHEMBL6109693 0.77 CDK1 (0.70) CSNK2A1MAPTCDK1MAPK1CDK2
SCHEMBL6107344 0.77 CSNK2A1 (0.77) CSNK2A1MAPTCDK1MAPK1CDK2
SCHEMBL7817279 0.76 CDK1 (0.77) CSNK2A1MAPTCDK1MAPK1CDK2
SCHEMBL14040966 0.76 CDK1 (0.85) CSNK2A1MAPTCDK1MAPK1CDK2
SCHEMBL16496154 0.75 CAMK2D (0.54) CSNK2A1MAPTCDK1MAPK1CDK2
SCHEMBL6109242 0.75 CDK2 (0.62) CSNK2A1MAPTCDK1MAPK1CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2205086-B1 FUNGICIDAL HETEROCYCLIC AMINES DU PONT (US) 2013-08-14 — — EP disclosed
US-20110301123-A1 Fungicidal Heterocyclic Amines E.I. DU PONT NEMOURS AND COMPANY (US) 2011-12-08 — — US disclosed
US-8026359-B2 Fungicidal heterocyclic amines E.I. DU PONT DE NEMOURS AND COMPANY (US) 2011-09-27 — — US disclosed
US-20100267729-A1 FUNGICIDAL HETEROCYCLIC AMINES E.I. DU PONT DE NEMOURS AND COMPANY (DE) 2010-10-21 — — 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-20100267729-A1 FUNGICIDAL HETEROCYCLIC AMINES PRMT9, MAOB, CYP2C9 CSNK2A1 2945/4885MAPT 3679/4885CDK1 435/4885
US-20110301123-A1 Fungicidal Heterocyclic Amines PRMT9, MAOB, CYP2C9 CSNK2A1 2945/4885MAPT 3679/4885CDK1 435/4885

“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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