SCHEMBL31693012

SCHEMBL31693012

C=CC(=O)Nc1ccc(C(=N)N)cc1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 2/20 0.65
▸ PRSS1 P07477 1/20 0.65
▸ PRSS2 P07478 1/20 0.65
▸ PRSS3 P35030 1/20 0.65
▸ TMPRSS6 Q8IU80 1/20 0.65
▸ ST14 Q9Y5Y6 1/20 0.65
▸ TGM2 P21980 9/20 0.58
▸ F13A1 P00488 1/20 0.58
▸ LMNA P02545 1/20 0.58
▸ TGM1 P22735 1/20 0.58
▸ TGM3 Q08188 1/20 0.58
▸ F10 P00742 1/20 0.50
▸ PLG P00747 1/20 0.50
▸ PLAU P00749 1/20 0.50
▸ PLAT P00750 1/20 0.50
▸ ITGB3 P05106 1/20 0.49
▸ ITGA2B P08514 1/20 0.49

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
SCHEMBL6357758 0.85 TGM2 (0.61) TGM2F13A1LMNATGM1TGM3
SCHEMBL439369 0.82 TGM2 (0.79) TGM2F13A1LMNATGM1TGM3
SCHEMBL890715 0.79 TGM2 (0.68) TGM2F13A1LMNATGM1TGM3
SCHEMBL17327878 0.79 TGM2 (0.63) TGM2F13A1LMNATGM1TGM3
SCHEMBL7138521 0.79 ALDH1A1 (0.64) F2PRSS1PRSS2PRSS3TMPRSS6
SCHEMBL4553738 0.79 F2 (0.77) F2PRSS1PRSS2PRSS3TMPRSS6
SCHEMBL9425693 0.78 F2 (0.59) F2PRSS1PRSS2PRSS3TMPRSS6
SCHEMBL4665815 0.78 F2 (0.59) F2PRSS1PRSS2PRSS3TMPRSS6
Hydrochloric Acid SCHEMBL6983843 0.78 ALDH1A1 (0.62) F2PRSS1PRSS2PRSS3TMPRSS6
SCHEMBL7470743 0.78 TGM2 (0.67) TGM2F13A1LMNATGM1TGM3

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
WO-2025202518-A1 MEASURE OF A QUINOLINATE AND TRYPTOPHAN CONCENTRATION Institut National de la Santé et de la Recherche Médicale (FR) 2025-10-02 — — WO claimed
WO-2025202518-A1 MEASURE OF A QUINOLINATE AND TRYPTOPHAN CONCENTRATION Institut National de la Santé et de la Recherche Médicale (FR) 2025-10-02 — — WO disclosed
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