SCHEMBL29390128

SCHEMBL29390128

NC(=O)c1cnn(Cc2cnc(N3CCCC3)nc2)c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 2/20 0.41
▸ KLKB1 P03952 4/20 0.40
▸ KLK1 P06870 1/20 0.40
▸ KIT P10721 1/20 0.40
▸ AOC3 Q16853 3/20 0.37
▸ SCD O00767 2/20 0.36
▸ SCD5 Q86SK9 2/20 0.36
▸ OPRM1 P35372 1/20 0.36
▸ OPRK1 P41145 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ HDAC6 Q9UBN7 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ PDE4B Q07343 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ LMNA P02545 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
SCHEMBL31075273 0.85 L3MBTL1 (0.46) BTKKLKB1KLK1SCDSCD5
SCHEMBL31075230 0.79 POLB (0.44) BTKALDH1A1KDM4EMAPTPDE4B
SCHEMBL25424630 0.79 MAPT (0.48) BTKKLKB1AOC3SCDSCD5
SCHEMBL20917117 0.76 POLB (0.50) AOC3OPRM1OPRK1ALDH1A1KDM4E
SCHEMBL4790004 0.75 POLB (0.49) AOC3ALDH1A1KDM4EHDAC6MAPT
SCHEMBL26969961 0.74 SCD (0.49) SCDSCD5ALDH1A1MAPTLMNA
SCHEMBL15964732 0.73 KLKB1 (0.60) KLKB1SCD5ALDH1A1KDM4EHSD17B10
SCHEMBL18816572 0.72 BTK (0.55) BTKKLKB1HDAC6HSD17B10
SCHEMBL31591076 0.72 KLKB1 (0.51) KLKB1KLK1ALDH1A1KDM4EMAPT
SCHEMBL23774133 0.71 BTK (0.55) BTKKLKB1HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230250080-A1 ENZYME INHIBITORS KALVISTA PHARMACEUTICALS LTD (GB) 2023-08-10 — — US disclosed
US-11613527-B2 Enzyme inhibitors KALVISTA PHARMACEUTICALS LIMITED (GB) 2023-03-28 — — US disclosed
CN-114206852-A Plasma kallikrein inhibitors 卡尔维斯塔制药有限公司 2022-03-18 — — CN disclosed
US-20220048894-A1 ENZYME INHIBITORS KALVISTA PHARMACEUTICALS LIMITED (GB) 2022-02-17 — — 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 (3 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-20230250080-A1 ENZYME INHIBITORS SERPINB1, KLKB1, SERPINE1 BTK 1126/4885KLKB1 2/4885KLK1 10/4885
US-11613527-B2 Enzyme inhibitors SERPINB1, KLKB1, SERPINE1 BTK 1126/4885KLKB1 2/4885KLK1 10/4885
US-20220048894-A1 ENZYME INHIBITORS SERPINB1, KLKB1, SERPINE1 BTK 1126/4885KLKB1 2/4885KLK1 10/4885

“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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