SCHEMBL24758142

SCHEMBL24758142

CC(=O)c1cc(C#N)[nH]n1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HCAR2 Q8TDS4 10/20 0.37
▸ DAO P14920 1/20 0.37
▸ AR P10275 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ HCAR3 P49019 2/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ LCK P06239 1/20 0.32
▸ RET P07949 1/20 0.32
▸ SRC P12931 1/20 0.32
▸ CYTH3 O43739 1/20 0.31
▸ BTK Q06187 1/20 0.31
▸ EPN1 Q9Y6I3 1/20 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
SCHEMBL10340622 0.82 HCAR2 (0.52) HCAR2DAOHCAR3CYTH3BTK
SCHEMBL8058650 0.80 MAPK8 (0.39) HCAR2DAOSMN1; SMN2KDM4EMAPK1
SCHEMBL24117299 0.76 MAPK1 (0.39) HCAR2KDM4EHCAR3MAPK1
SCHEMBL2629428 0.71 — —
SCHEMBL12011328 0.71 MAPK1 (0.52) HCAR2DAOKDM4EHCAR3MAPK1
SCHEMBL4035315 0.71 — —
SCHEMBL6212668 0.69 — —
SCHEMBL12270026 0.69 — —
SCHEMBL1815487 0.68 MAPK1 (0.48) HCAR2DAOHCAR3MAPK1
SCHEMBL27864493 0.68 HCAR2 (0.53) HCAR2DAOHCAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11999699-B2 Substituted pyrazole amides Grünenthal GmbH (DE) 2024-06-04 — — US disclosed
WO-2023215801-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF KUMQUAT BIOSCIENCES INC. (US) 2023-11-09 — — WO disclosed
US-20230025025-A1 SUBSTITUTED PYRAZOLE AMIDES GRUENENTHAL GMBH (DE) 2023-01-26 — — US disclosed
US-20230025025-A1 SUBSTITUTED PYRAZOLE AMIDES GRUENENTHAL GMBH (DE) 2023-01-26 — — US disclosed
WO-2022263498-A1 SUBSTITUTED PYRAZOLE AMIDES Grünenthal GmbH (DE) 2022-12-22 — — WO 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-11999699-B2 Substituted pyrazole amides SCN8A, SCN1A, SCN7A HCAR2 565/4885DAO 3599/4885AR 3341/4885
US-20230025025-A1 SUBSTITUTED PYRAZOLE AMIDES SCN8A, SCN1A, SCN7A HCAR2 565/4885DAO 3599/4885AR 3341/4885

“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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