SCHEMBL16699389

SCHEMBL16699389

NC(=O)N1CCn2ncc(C(=O)NC34CCC(F)(CC3)CC4)c2C1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CASR P41180 1/20 0.31
▸ CSNK1D P48730 2/20 0.31
▸ CSNK1E P49674 2/20 0.31

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
SCHEMBL16700166 0.84 CASR (0.36) CASRCSNK1DCSNK1E
SCHEMBL16698729 0.82 CD38 (0.31) —
SCHEMBL16718784 0.80 CSNK1D (0.36) CSNK1DCSNK1E
SCHEMBL16700182 0.77 — —
SCHEMBL28611830 0.76 CSNK1D (0.36) CSNK1DCSNK1E
SCHEMBL16699410 0.75 CSNK1E (0.40) CSNK1DCSNK1E
SCHEMBL16700861 0.72 — —
SCHEMBL23778990 0.70 CSNK1D (0.36) CSNK1DCSNK1E
SCHEMBL23779001 0.68 JAK2 (0.37) CSNK1DCSNK1E
SCHEMBL22054092 0.63 CSNK1E (0.52) CSNK1DCSNK1E

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-9273058-B2 Substituted pyrazolo-piperazines as casein kinase 1 δ/ε inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2016-03-01 — — US disclosed
US-20150133428-A1 NOVEL SUBSTITUTED PYRAZOLO-PIPERAZINES AS CASEIN KINASE 1 D/E INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2015-05-14 — — 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-20150133428-A1 NOVEL SUBSTITUTED PYRAZOLO-PIPERAZINES AS CASEIN KINASE 1 D/E INHIBITORS CSNK1E, CSNK1A1, CSNK1G1 CASR 2782/4885CSNK1D 7/4885CSNK1E 1/4885

“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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