SCHEMBL104896

SCHEMBL104896

CCn1nc(N)ccc1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ PTGS2 P35354 1/20 0.33
▸ HSF1 Q00613 1/20 0.33
▸ HRH3 Q9Y5N1 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ MET P08581 1/20 0.33
▸ ADORA1 P30542 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ BRD4 O60885 1/20 0.31
▸ BPTF Q12830 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ ADORA2A P29274 1/20 0.31
▸ TSHR P16473 1/20 0.31

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
SCHEMBL9362665 0.77 HRH3 (0.36) GAAKMT2APTGS2HRH3ALDH1A1
SCHEMBL10196841 0.77 GAA (0.40) GAAKMT2APTGS2HRH3ALDH1A1
SCHEMBL24077344 0.76 ADRA1A (0.37) ALDH1A1ADORA1KDM4ESMN1; SMN2ADORA2A
SCHEMBL24076322 0.76 MPO (0.40) KMT2APTGS2ALDH1A1KDM4EHSD17B10
SCHEMBL8149332 0.75 MAPT (0.36) GAAPTGS2HRH3ALDH1A1HTT
SCHEMBL12877231 0.75 TSHR (0.37) GAAKMT2APTGS2HRH3ALDH1A1
SCHEMBL17723466 0.75 PTGS2 (0.36) GAAKMT2APTGS2HRH3ALDH1A1
SCHEMBL25280792 0.75 MET (0.39) GAAKMT2APTGS2HRH3ALDH1A1
SCHEMBL24246974 0.73 HRH3 (0.37) GAAKMT2APTGS2HRH3ALDH1A1
SCHEMBL21384024 0.72 MARS1 (0.43) GAAKMT2AALDH1A1HTTKDM4E

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026101698-A1 HEPCIDIN MIMETIC COMPOUNDS AND USES THEREOF PROTAGONIST THERAPEUTICS, INC. (US) 2026-05-15 — — WO disclosed
US-12268687-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2025-04-08 — — US disclosed
US-20250034125-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2025-01-30 — — US disclosed
US-20250034124-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2025-01-30 — — US disclosed
US-12098146-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-09-24 — — US disclosed
US-20230116101-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. 2023-04-13 — — US disclosed
CN-113906019-A Compound and use thereof 优曼尼蒂治疗公司 2022-01-07 — — CN disclosed
EP-3914593-A1 COMPOUNDS AND USES THEREOF Yumanity Therapeutics, Inc. (US) 2021-12-01 — — EP disclosed
WO-2021097240-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2021-05-20 — — WO disclosed
US-20210139471-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2021-05-13 — — US disclosed
CN-101835755-B Novel kinase inhibitors HOFFMANN LA ROCHE 2013-12-11 — — CN disclosed
EP-2426109-A1 NOVEL KINASE INHIBITORS F. Hoffmann-La Roche AG (CH) 2012-03-07 — — EP disclosed
US-7943618-B2 Btk protein kinase inhibitors ROCHE PALO ALTO LLC (US) 2011-05-17 — — US disclosed
CN-101835755-A Novel kinase inhibitors HOFFMANN LA ROCHE 2010-09-15 — — CN disclosed
EP-2205564-A1 NOVEL KINASE INHIBITORS F. Hoffmann-Roche AG (CH) 2010-07-14 — — EP disclosed
WO-2009053269-A1 NOVEL KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2009-04-30 — — WO disclosed
US-20090105209-A1 BTK protein kinase inhibitors ROCHE PALO ALTO LLC 2009-04-23 — — US disclosed
EP-0489327-B1 Chroman derivatives MERCK PATENT GMBH (DE) 1998-05-27 — — EP disclosed
US-5238937-A PYRIDAZINY OR OXODIHYDROPYRIDAZINYL CHROMAN DERIVATIVES MERCK PATENT GESELLSCHAFT (DE) 1993-08-24 — — US disclosed
EP-0489327-A1 Chroman derivatives MERCK PATENT GmbH (DE) 1992-06-10 — — EP 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 (7 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-20250034124-A1 COMPOUNDS AND USES THEREOF NLN, BDNF, NQO1 GAA 481/4885KMT2A 587/4885PTGS2 519/4885
US-12268687-B2 Compounds and uses thereof NLN, BDNF, NQO1 GAA 481/4885KMT2A 587/4885PTGS2 519/4885
US-20090105209-A1 BTK protein kinase inhibitors BTK, SYK, LYN GAA 3384/4885KMT2A 2703/4885PTGS2 2613/4885
US-20230116101-A1 COMPOUNDS AND USES THEREOF NLN, BDNF, NQO1 GAA 481/4885KMT2A 587/4885PTGS2 519/4885
US-20250034125-A1 COMPOUNDS AND USES THEREOF NLN, BDNF, NQO1 GAA 481/4885KMT2A 587/4885PTGS2 519/4885
US-20210139471-A1 COMPOUNDS AND USES THEREOF NLN, BDNF, NQO1 GAA 481/4885KMT2A 587/4885PTGS2 519/4885
US-12098146-B2 Compounds and uses thereof NLN, BDNF, NQO1 GAA 481/4885KMT2A 587/4885PTGS2 519/4885

“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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