SCHEMBL13258781

SCHEMBL13258781

N#Cc1cnc(N2CCNCC2)c2nc(-c3ccc(Cl)cc3)cn12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHEK1 O14757 2/20 0.40
▸ MAPKAPK2 P49137 1/20 0.40
▸ HRH4 Q9H3N8 3/20 0.40
▸ ROCK2 O75116 2/20 0.39
▸ ROCK1 Q13464 2/20 0.39
▸ CYP1A2 P05177 3/20 0.39
▸ CYP3A4 P08684 3/20 0.39
▸ USP2 O75604 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ CYP2C9 P11712 2/20 0.39
▸ CASP1 P29466 2/20 0.39
▸ CASP7 P55210 2/20 0.39
▸ HIF1A Q16665 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ GLA P06280 1/20 0.39
▸ HTR1A P08908 1/20 0.39
▸ HTR2A P28223 1/20 0.39
▸ HTR7 P34969 1/20 0.39
▸ HTR2B P41595 1/20 0.39

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
SCHEMBL13258875 0.79 CHEK1 (0.64) CHEK1MAPKAPK2PIM1
SCHEMBL13259792 0.77 CHEK1 (0.67) CHEK1MAPKAPK2CYP1A2HSD17B10CLK4
SCHEMBL13258965 0.74 HPGD (0.39) CHEK1MAPKAPK2CYP1A2USP2ALDH1A1
SCHEMBL13259773 0.72 CHEK1 (0.69) CHEK1MAPKAPK2
Hydrochloric Acid SCHEMBL30448659 0.71 CNR1 (0.44) MAPKAPK2HRH4ROCK2ROCK1CYP1A2
Hydrochloric Acid SCHEMBL29013594 0.71 CNR1 (0.44) MAPKAPK2HRH4ROCK2ROCK1CYP1A2
SCHEMBL13258798 0.70 CHEK1 (0.55) CHEK1MAPKAPK2ALDH1A1
SCHEMBL2401396 0.69 HRH4 (0.54) MAPKAPK2HRH4HTR1AHTR2AHTR7
SCHEMBL13259782 0.66 CHEK1 (0.49) CHEK1MAPKAPK2
SCHEMBL29157430 0.64 HTR3A (0.62) MAPKAPK2CYP1A2CYP3A4USP2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010088368-A2 IMIDAZOPYRAZINES AS PROTEIN KINASE INHIBITORS SCHERING CORPORATION (US) 2010-08-05 — — WO disclosed
US-20090175852-A1 IMIDAZOPYRAZINES AS PROTEIN KINASE INHIBITORS SCHERING CORPORATION 2009-07-09 — — US disclosed
US-20090175852-A1 IMIDAZOPYRAZINES AS PROTEIN KINASE INHIBITORS SCHERING CORPORATION 2009-07-09 — — 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-20090175852-A1 IMIDAZOPYRAZINES AS PROTEIN KINASE INHIBITORS CHEK1, CHEK2, CDKN1A CHEK1 1/4885MAPKAPK2 43/4885HRH4 2417/4885

“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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