SCHEMBL26715046

SCHEMBL26715046

c1csc(Cn2ncc3ccc(-c4ccc5c(c4)OCO5)nc32)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.46
▸ LMNA P02545 5/20 0.46
▸ MAPT P10636 5/20 0.46
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ NPC1 O15118 4/20 0.46
▸ RAB9A P51151 4/20 0.46
▸ KDM4E B2RXH2 4/20 0.46
▸ NFKB1 P19838 2/20 0.46
▸ NFKB2 Q00653 2/20 0.46
▸ RELA Q04206 2/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ CLK4 Q9HAZ1 5/20 0.44
▸ CYP2D6 P10635 4/20 0.44
▸ MAPK1 P28482 4/20 0.44
▸ CYP2C19 P33261 4/20 0.44
▸ MEN1 O00255 4/20 0.44
▸ KMT2A Q03164 4/20 0.44
▸ CYP1A2 P05177 3/20 0.44
▸ TSHR P16473 3/20 0.44
▸ TP53 P04637 3/20 0.44

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
SCHEMBL29802500 0.71 NR3C1 (0.43) ALDH1A1MAPTSMN1; SMN2KDM4EL3MBTL1
SCHEMBL23093119 0.71 NR3C1 (0.43) ALDH1A1MAPTSMN1; SMN2KDM4EL3MBTL1
SCHEMBL7004578 0.65 KDM4E (1.00) ALDH1A1LMNAMAPTSMN1; SMN2NPC1
SCHEMBL29746267 0.65 KDM4E (1.00) ALDH1A1LMNAMAPTSMN1; SMN2NPC1
SCHEMBL3249226 0.63 RPS6KB2 (0.57) ALDH1A1LMNAMAPTSMN1; SMN2NPC1
SCHEMBL22824500 0.62 RAB9A (0.65) ALDH1A1LMNAMAPTSMN1; SMN2NPC1
SCHEMBL7466888 0.61 RAB9A (0.62) ALDH1A1LMNAMAPTSMN1; SMN2NPC1
SCHEMBL19455590 0.61 ALDH1A1 (0.48) ALDH1A1LMNAMAPTSMN1; SMN2NPC1
SCHEMBL5329732 0.60 RAB9A (0.80) ALDH1A1LMNAMAPTSMN1; SMN2NPC1
SCHEMBL16855380 0.60 ALDH1A1 (0.61) ALDH1A1LMNAMAPTSMN1; SMN2NPC1

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
US-20230357099-A1 PYRAZOLO [3,4-B] PYRIDINE-4-CARBOXAMIDE NITRIFICATION INHIBITOR EUROCHEM ANTWERPEN (BE) 2023-11-09 — — US disclosed
US-20230357099-A1 PYRAZOLO [3,4-B] PYRIDINE-4-CARBOXAMIDE NITRIFICATION INHIBITOR EUROCHEM ANTWERPEN (BE) 2023-11-09 — — 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-20230357099-A1 PYRAZOLO [3,4-B] PYRIDINE-4-CARBOXAMIDE NITRIFICATION INHIBITOR CBR1, CYC1, CBR3 ALDH1A1 1065/4885LMNA 4241/4885MAPT 4363/4885

“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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