SCHEMBL18171283

SCHEMBL18171283

CC1CN(C(N)=O)Cc2c(C(=O)Nc3ccc(C#N)cc3)c(-c3cccc(F)c3)nn21

nearest known ligand 0.80

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 19/20 0.80
CSNK1D P48730 12/20 0.80
CREBBP Q92793 1/20 0.43

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
SCHEMBL18171294 0.89 CSNK1E (0.80) CSNK1ECSNK1DCREBBP
SCHEMBL16722445 0.89 CSNK1E (1.00) CSNK1ECSNK1D
SCHEMBL16700825 0.83 CSNK1E (0.60) CSNK1ECSNK1D
SCHEMBL16699676 0.82 CSNK1E (0.58) CSNK1ECSNK1D
SCHEMBL18171127 0.81 CSNK1E (0.55) CSNK1ECSNK1D
SCHEMBL18183997 0.79 CSNK1E (0.88) CSNK1ECSNK1D
SCHEMBL16699959 0.79 CSNK1E (0.82) CSNK1ECSNK1D
SCHEMBL18184025 0.78 CSNK1E (1.00) CSNK1ECSNK1D
SCHEMBL18171250 0.78 CSNK1E (0.81) CSNK1ECSNK1DCREBBP
SCHEMBL16701004 0.76 CSNK1E (0.68) CSNK1ECSNK1D

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-9598423-B2 Substituted 4,5,6,7-tetrahydropyrazolo[1,5-A]pyrazine derivatives as casein kinase 1 D/E inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2017-03-21 US disclosed
US-20160311824-A1 SUBSTITUTED 4,5,6,7-TETRAHYDROPYRAZOLO[1,5-A]PYRAZINE DERIVATIVES AS CASEIN KINASE 1 D/E INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2016-10-27 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-20160311824-A1 SUBSTITUTED 4,5,6,7-TETRAHYDROPYRAZOLO[1,5-A]PYRAZINE DERIVATIVES AS CASEIN KINASE 1 D/E INHIBITORS CSNK1A1, CSNK1E, CSNK1G1 CSNK1E 2/4885CSNK1D 6/4885CREBBP 1025/4885

“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.