SCHEMBL31010386

SCHEMBL31010386

NC(=O)c1[nH]nc(C2CC2)c1C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CCNC P24863 1/20 0.38
▸ CDK8 P49336 1/20 0.38
▸ UMPS P11172 2/20 0.33
▸ HCAR2 Q8TDS4 1/20 0.32
▸ LMNA P02545 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ CCNA2 P20248 2/20 0.31
▸ CDK2 P24941 2/20 0.31
▸ CCNA1 P78396 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
SCHEMBL16963927 0.70 PROKR1 (0.30) —
SCHEMBL15565941 0.70 UMPS (0.35) UMPSHCAR2CCNA2CDK2CCNA1
SCHEMBL31010394 0.70 CCNC (0.35) CCNCCDK8
SCHEMBL15566755 0.68 PARP1 (0.32) UMPS
SCHEMBL31010385 0.68 CCNC (0.33) CCNCCDK8
SCHEMBL27737484 0.66 HCAR2 (0.39) HCAR2LMNAPOLBCCNA2CDK2
SCHEMBL15566870 0.65 MAPT (0.35) UMPSPOLB
SCHEMBL17224842 0.62 HCAR2 (0.40) HCAR2CCNA2CDK2CCNA1
SCHEMBL17479269 0.62 HCAR2 (0.40) HCAR2CCNA2CDK2CCNA1
SCHEMBL30486146 0.62 MEN1 (0.33) —

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-20240252473-A1 Sulfoximines as inhibitors of NaV1.8 GRUENENTHAL GMBH (DE) 2024-08-01 — — 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-20240252473-A1 Sulfoximines as inhibitors of NaV1.8 SCN8A, SCN10A, SCN7A CCNC 4731/4885CDK8 660/4885UMPS 2903/4885

“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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