SCHEMBL31660043

SCHEMBL31660043

Cc1cncc(C(=O)N(C)Cc2ccncc2)c1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MMP13 P45452 1/20 0.60
▸ KMT2A Q03164 3/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ NAMPT P43490 3/20 0.46
▸ HCAR2 Q8TDS4 1/20 0.46
▸ GAA P10253 1/20 0.43
▸ ATM Q13315 1/20 0.43
▸ ROCK2 O75116 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ ACACB O00763 1/20 0.42
▸ TACR1 P25103 1/20 0.41
▸ PARP1 P09874 1/20 0.39
▸ HSP90AA1 P07900 1/20 0.39
▸ GRK2 P25098 1/20 0.39
▸ VNN1 O95497 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
SCHEMBL18773998 0.83 MEN1 (0.61) MMP13KMT2AMEN1NAMPTROCK2
SCHEMBL13211819 0.82 MMP13 (0.84) MMP13KMT2AMEN1NAMPTPOLB
SCHEMBL12678010 0.79 HCAR2 (0.55) KMT2AMEN1NAMPTHCAR2ATM
SCHEMBL11187328 0.77 KMT2A (0.66) MMP13KMT2AMEN1NAMPTROCK2
SCHEMBL17297343 0.76 HCAR2 (0.51) KMT2AMEN1HCAR2ATM
SCHEMBL12459627 0.75 MMP13 (0.57) MMP13KMT2AMEN1NAMPTGAA
SCHEMBL17297327 0.75 HCAR2 (0.50) KMT2AMEN1HCAR2ATM
SCHEMBL12048998 0.74 HCAR2 (0.62) KMT2AMEN1HCAR2ATM
SCHEMBL14625555 0.74 MMP13 (0.53) MMP13KMT2AMEN1NAMPTROCK2
SCHEMBL30633434 0.73 MEN1 (0.60) MMP13KMT2AMEN1NAMPTROCK2

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-20250230155-A1 7,8-DIHYDRO-5H-1,6-NAPHTHYRIDINE DERIVATIVES AS POSITIVE ALLOSTERIC MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 FOR TREATING NEUROLOGICAL AND PSYCHIATRIC DISORDERS VANDERBILT UNIVERSITY 2025-07-17 — — 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-20250230155-A1 7,8-DIHYDRO-5H-1,6-NAPHTHYRIDINE DERIVATIVES AS POSITIVE ALLOSTERIC MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 FOR TREATING NEUROLOGICAL AND PSYCHIATRIC DISORDERS CHRM5, CHRM4, CHRM1 MMP13 4685/4885KMT2A 832/4885MEN1 2532/4885

“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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