SCHEMBL29405851

SCHEMBL29405851

Nc1nc(Cl)c2ncn(CCCCCB(O)O)c2n1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 5/20 0.47
▸ HDAC1 Q13547 5/20 0.47
▸ HDAC4 P56524 1/20 0.47
▸ HSP90AB1 P08238 13/20 0.46
▸ HSP90AA1 P07900 12/20 0.46
▸ TK1 P04183 1/20 0.43
▸ HDAC2 Q92769 1/20 0.43

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
SCHEMBL7111193 1.00 HDAC6 (0.47) HDAC6HDAC1HDAC4HSP90AB1HSP90AA1
SCHEMBL6061207 0.99 HDAC6 (0.48) HDAC6HDAC1HDAC4HSP90AB1HSP90AA1
SCHEMBL24941702 0.84 TK1 (0.60) HDAC6HDAC1HDAC4HSP90AB1HSP90AA1
SCHEMBL2098713 0.82 HSP90AB1 (0.53) HDAC6HDAC1HDAC4HSP90AB1HSP90AA1
SCHEMBL4847394 0.81 HSP90AB1 (0.53) HSP90AB1HSP90AA1
SCHEMBL5172274 0.80 ADORA2A (0.55) HSP90AB1HSP90AA1
SCHEMBL27863480 0.80 HSP90AB1 (0.51) HDAC6HDAC1HDAC4HSP90AB1HSP90AA1
SCHEMBL31058755 0.79 HDAC6 (0.54) HDAC6HDAC1HDAC4HSP90AB1HSP90AA1
SCHEMBL6061412 0.79 FDPS (0.49) HDAC6
SCHEMBL19553602 0.77 HSP90AB1 (0.47) HDAC6HDAC1HDAC4HSP90AB1HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122029273-A Compositions and methods for activating immune cells MDX管理有限责任公司 2026-05-12 — — CN disclosed
EP-4680215-A1 COMPOSITIONS AND METHODS FOR AMELIORATING ADVERSE EFFECTS OF THERAPIES MDX Management LLC (US) 2026-01-21 — — EP disclosed
EP-4673544-A1 METHODS AND COMPOSITIONS FOR INHIBITING PROGRESSION OF INTRAMUSCULAR FIBROSIS Dyne Therapeutics, Inc. (US) 2026-01-07 — — EP disclosed
EP-4667054-A2 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY Novartis AG (CH) 2025-12-24 — — EP disclosed
EP-3880660-B1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2025-07-02 — — EP disclosed
CN-113166065-B Compounds and compositions for treating disorders associated with NLRP activity 诺华股份有限公司 2025-04-15 — — CN disclosed
WO-2025038745-A1 COMPOSITIONS AND METHODS FOR ACTIVATING IMMUNE CELLS MDX MANAGEMENT LLC (US) 2025-02-20 — — WO disclosed
US-20250000364-A1 GASTROINTESTINAL TRACT DETECTION METHODS, DEVICES AND SYSTEMS GLAS USA LLC 2025-01-02 — — US disclosed
US-20240391884-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2024-11-28 — — US disclosed
CN-118873822-A Treatment of gastrointestinal disorders with TNF inhibitors 比奥拉治疗股份有限公司 2024-11-01 — — CN disclosed
US-20220273196-A1 INGESTIBLE DEVICE AND ASSOCIATED METHODS GLAS USA LLC 2022-09-01 — — US disclosed
US-20220267276-A1 NLRP MODULATORS NOVARTIS INFLAMMASOME RESEARCH, INC. 2022-08-25 — — US disclosed
EP-4045480-A1 PHARMACEUTICAL FORMULATIONS First Wave Bio, Inc. (US) 2022-08-24 — — EP disclosed
US-20220249814-A1 METHODS AND DEVICES FOR TREATING A DISEASE WITH BIOTHERAPEUTICS GLAS USA LLC 2022-08-11 — — US disclosed
US-20220227707-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2022-07-21 — — US disclosed
EP-3697758-B1 SULPHONAMIDES AND COMPOSITIONS THEREOF FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2022-07-06 — — EP disclosed
US-11370763-B2 Compounds and compositions for treating conditions associated with NLRP activity NOVARTIS AG (CH) 2022-06-28 — — US disclosed
WO-2022087313-A1 METHODS OF TREATING AND PREDICTING NON-RESPONSE TO ANTI-TNF TREATMENT IN SUBJECTS WITH GASTROINTESTINAL TRACT DISEASES PROGENITY, INC. (US) 2022-04-28 — — WO disclosed
US-20220105057-A1 METHODS OF TREATMENT FIRST WAVE BIO, INC. 2022-04-07 — — US disclosed
US-20220079897-A1 METHODS OF TREATMENT FIRST WAVE BIO, INC. 2022-03-17 — — 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 (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-20220079897-A1 METHODS OF TREATMENT ACE2, ACE, SI HDAC6 840/4885HDAC1 2388/4885HDAC4 2449/4885
US-20220105057-A1 METHODS OF TREATMENT ACE2, ACE, SI HDAC6 570/4885HDAC1 2090/4885HDAC4 2043/4885
US-20250000364-A1 GASTROINTESTINAL TRACT DETECTION METHODS, DEVICES AND SYSTEMS FABP2, SI, MLNR HDAC6 3455/4885HDAC1 4841/4885HDAC4 4099/4885
US-20240391884-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 HDAC6 569/4885HDAC1 575/4885HDAC4 1858/4885
US-20220267276-A1 NLRP MODULATORS NLRP1, NRP1, NR4A3 HDAC6 1756/4885HDAC1 1041/4885HDAC4 1459/4885
US-11370763-B2 Compounds and compositions for treating conditions associated with NLRP activity NLRP3, NLRP1, IAPP HDAC6 1324/4885HDAC1 932/4885HDAC4 1960/4885
US-20220227707-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 HDAC6 522/4885HDAC1 487/4885HDAC4 1653/4885

“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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