SCHEMBL7400591

SCHEMBL7400591

CCOC(=O)c1nc(C)no1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.52
CYP1A2 P05177 2/20 0.43
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA7 P43166 2/20 0.40
CA9 Q16790 2/20 0.40
CA14 Q9ULX7 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40
SLC2A1 P11166 1/20 0.40
CACNA1F O60840 1/20 0.40
CACNA1D Q01668 1/20 0.40
CACNA1S Q13698 1/20 0.40
CACNA1C Q13936 1/20 0.40
ALDH1A1 P00352 2/20 0.39
LMNA P02545 1/20 0.39
CYP3A4 P08684 1/20 0.39

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
SCHEMBL15284739 0.81 HTT (0.50) HTTCYP1A2MEN1KMT2ACACNA1F
SCHEMBL9461101 0.81 HTT (0.50) HTTCYP1A2MEN1KMT2ACACNA1F
SCHEMBL3559987 0.80 HTT (0.49) HTTCYP1A2CA1CA2MEN1
SCHEMBL13733197 0.80 HTT (0.49) HTTCYP1A2CACNA1FCACNA1DCACNA1S
SCHEMBL21547848 0.80 NPSR1 (0.43) HTTKMT2AALDH1A1MAPT
SCHEMBL2254343 0.79 HTT (0.48) HTTCYP1A2MEN1KMT2ACACNA1F
SCHEMBL1815124 0.79 HTT (0.48) HTTCYP1A2MEN1KMT2ACACNA1F
Hydrochloric Acid SCHEMBL4493041 0.79 HTT (0.48) HTTCYP1A2CA1CA2MEN1
SCHEMBL12410861 0.79 HTT (0.48) HTTCYP1A2MEN1KMT2ACACNA1F
Hydrochloric Acid SCHEMBL3559985 0.79 HTT (0.48) HTTCYP1A2CA1CA2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113272309-B Tricyclic inhibitors of hepatitis b virus 圣拉斐尔医院有限公司 2024-02-23 CN disclosed
US-11851425-B2 Combination treatments comprising administration of 1H-pyrazolo[4,3-B]pyridines H. LUNDBECK A/S (DK) 2023-12-26 US disclosed
US-20230340011-A1 STEROIDAL COMPOSITIONS AND METHODS OF TREATING LIPOGENIC CANCERS Asteroid Therapeutics 2023-10-26 US disclosed
US-20230340011-A1 STEROIDAL COMPOSITIONS AND METHODS OF TREATING LIPOGENIC CANCERS Asteroid Therapeutics 2023-10-26 US disclosed
CN-111556871-B 1H-pyrazolo [4,3-b ] pyridines as PDE1 inhibitors H.隆德贝克有限公司 2023-07-07 CN disclosed
US-11634416-B2 Combination treatments comprising administration of 1H-pyrazolo[4,3-b]pyridines H. LUNDBECK A/S (DK) 2023-04-25 US disclosed
US-11491140-B2 1H-pyrazolo[4,3-b]pyridines as PDE1 inhibitors H. LUNDBECK A/S (DK) 2022-11-08 US disclosed
CN-111465410-B Combination therapy comprising administration of 1H-pyrazolo [4,3-B ] pyridine H.隆德贝克有限公司 2022-10-25 CN disclosed
CN-111526890-B Combination therapy comprising administration of 1H-pyrazolo [4,3-B ] pyridine H.隆德贝克有限公司 2022-10-14 CN disclosed
EP-3723808-B1 COMBINATION TREATMENTS COMPRISING ADMINISTRATION OF 1H-PYRAZOLO[4,3-B]PYRIDINES H LUNDBECK AS (DK) 2021-10-20 EP disclosed
US-7456210-B2 Benzyloxy derivatives HOFFMANN-LA ROCHE INC. (US) 2008-11-25 US disclosed
US-7456210-B2 Benzyloxy derivatives HOFFMANN-LA ROCHE INC. (US) 2008-11-25 US disclosed
US-20070249655-A1 4-Substituted-1,5-Dihydro-Pyrido[3,2-B]Indol-2-Ones KESTELEYN BART R R 2007-10-25 US disclosed
US-20070249655-A1 4-Substituted-1,5-Dihydro-Pyrido[3,2-B]Indol-2-Ones KESTELEYN BART R R 2007-10-25 US disclosed
US-20070129365-A1 6-Substituted pyridoindolone derivatives, production and therapeutic use thereof SANOFI-AVENTIS (FR) 2007-06-07 US disclosed
US-20070129365-A1 6-Substituted pyridoindolone derivatives, production and therapeutic use thereof SANOFI-AVENTIS (FR) 2007-06-07 US disclosed
US-6465462-B1 COGNITION ENHANCEMENT FOR DEMENTING ILLNESSES SUCH AS ALZHEIMER'S DISEASE MERCK SHARP & DOHME LTD. 2002-10-15 US disclosed
EP-0915877-A1 SUBSTITUTED TRIAZOLO PYRIDAZINE DERIVATIVES AS INVERSE AGONISTS OF THE GABA A?$g(a)5 RECEPTOR SUBTYPE MERCK SHARP & DOHME LTD. (GB) 1999-05-19 EP disclosed
WO-1998004560-A1 SUBSTITUTED TRIAZOLO PYRIDAZINE DERIVATIVES AS INVERSE AGONISTS OF THE GABAAα5 RECEPTOR SUBTYPE MERCK SHARP & DOHME LIMITED (GB) 1998-02-05 WO disclosed
US-3969365-A ANTIINFLAMMATORY, HYPOGLYCEMIC E. R. SQUIBB & SONS, INC. (US) 1976-07-13 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 (6 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-11851425-B2 Combination treatments comprising administration of 1H-pyrazolo[4,3-B]pyridines PDE3B, PDE1B, PDE12 HTT 551/4885CYP1A2 316/4885CA12 4304/4885
US-20070249655-A1 4-Substituted-1,5-Dihydro-Pyrido[3,2-B]Indol-2-Ones CYP8B1, CYP2S1, CYC1 HTT 1603/4885CYP1A2 14/4885CA12 4872/4885
US-11491140-B2 1H-pyrazolo[4,3-b]pyridines as PDE1 inhibitors PDE3A, PDE5A, PDE12 HTT 1345/4885CYP1A2 157/4885CA12 4726/4885
US-11634416-B2 Combination treatments comprising administration of 1H-pyrazolo[4,3-b]pyridines PDE1B, PDE3B, PDE1A HTT 2881/4885CYP1A2 96/4885CA12 3903/4885
US-20230340011-A1 STEROIDAL COMPOSITIONS AND METHODS OF TREATING LIPOGENIC CANCERS SREBF1, SREBF2, NR1H3 HTT 4516/4885CYP1A2 935/4885CA12 4344/4885
US-20070129365-A1 6-Substituted pyridoindolone derivatives, production and therapeutic use thereof PNPO, CYP2D6, DPYD HTT 1572/4885CYP1A2 61/4885CA12 4682/4885

“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.