SCHEMBL31659930

SCHEMBL31659930

NC(=O)c1cccnc1Cc1cncs1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PARP15 Q460N3 1/20 0.46
▸ PARP10 Q53GL7 1/20 0.46
▸ PARP1 P09874 1/20 0.41
▸ SYK P43405 6/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ TDP1 Q9NUW8 1/20 0.36
▸ MAPK8 P45983 1/20 0.36
▸ RAB9A P51151 2/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ AHR P35869 1/20 0.35

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
SCHEMBL4173670 0.80 KDM4E (0.47) PARP1SYKKDM4EALDH1A1HPGD
SCHEMBL7082682 0.75 RECQL (0.49) PARP1KDM4EALDH1A1SMN1; SMN2MAPK8
SCHEMBL31659683 0.75 RECQL (0.49) PARP1KDM4EALDH1A1SMN1; SMN2MAPK8
SCHEMBL19028143 0.75 CYP17A1 (0.47) PARP1SYKKDM4EALDH1A1HPGD
SCHEMBL31659783 0.75 CYP17A1 (0.47) PARP1SYKKDM4EALDH1A1HPGD
SCHEMBL30666151 0.74 PARP1 (0.51) PARP1SYKKDM4EALDH1A1HPGD
SCHEMBL31659925 0.73 PARP1 (0.42) PARP1SYKKDM4EALDH1A1HPGD
SCHEMBL2306128 0.73 SYK (0.48) PARP1SYKKDM4EALDH1A1HPGD
SCHEMBL1937751 0.72 PARP1 (0.53) PARP1SYKKDM4EALDH1A1HPGD
SCHEMBL497429 0.72 PARP1 (0.53) PARP1SYKKDM4EALDH1A1HPGD

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 PARP15 2875/4885PARP10 3422/4885PARP1 4029/4885

“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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