SCHEMBL29947713

SCHEMBL29947713

COc1cccc(CN)c1

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.71
MAOB P27338 4/20 0.71
IDO1 P14902 2/20 0.66
AGXT P21549 2/20 0.66
AOC3 Q16853 1/20 0.58
CHRM2 P08172 1/20 0.56
CHRM1 P11229 1/20 0.56
CHRM3 P20309 1/20 0.56
LPO P22079 1/20 0.56
CMA1 P23946 1/20 0.55
ALDH1A1 P00352 1/20 0.54
CYP3A4 P08684 1/20 0.54
SIGMAR1 Q99720 1/20 0.53

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
SCHEMBL42954 1.00 TAAR1 (0.71) TAAR1MAOBIDO1AGXTAOC3
Bromide SCHEMBL31513707 0.98 TAAR1 (0.69) TAAR1MAOBIDO1AGXTAOC3
Hydrochloric Acid SCHEMBL1275116 0.98 MAOB (0.72) TAAR1MAOBIDO1AGXTAOC3
SCHEMBL920587 0.92 MAOB (0.63) TAAR1MAOBIDO1AGXTAOC3
Hydrochloric Acid SCHEMBL18641342 0.91 MAOB (0.64) TAAR1MAOBIDO1AGXTAOC3
Hydrochloric Acid SCHEMBL18641293 0.91 MAOB (0.64) TAAR1MAOBIDO1AGXTAOC3
SCHEMBL921289 0.87 MAOB (0.61) TAAR1MAOBIDO1AGXTAOC3
Hydrochloric Acid SCHEMBL18641331 0.85 MAOB (0.62) TAAR1MAOBIDO1AGXTAOC3
Anisole SCHEMBL11636165 0.84 LOXL2 (0.64) TAAR1MAOBIDO1AGXTALDH1A1
SCHEMBL1680537 0.84 MAOB (1.00) TAAR1MAOBIDO1AGXT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260116879-A1 AZAINDOLE ROCK INHIBITORS AVICENNA BIOSCIENCES, INC. (US) 2026-04-30 US disclosed
EP-4719385-A2 1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-AMINES AS ANTI-INFECTIOUS AGENTS University of Vermont and State Agricultural College (US) 2026-04-08 EP disclosed
EP-4642764-A2 AZAINDOLE ROCK INHIBITORS Avicenna Biosciences, Inc. (US) 2025-11-05 EP disclosed
US-12428413-B2 Rho kinase inhibitors and compositions and methods of use thereof CHDI FOUNDATION, INC. (US) 2025-09-30 US disclosed
US-12415805-B2 Azaindole rock inhibitors AVICENNA BIOSCIENCES, INC. (US) 2025-09-16 US disclosed
CN-119816306-A Treatment of Aplastic Anemia (AA) 载度思生命科学有限公司 2025-04-11 CN disclosed
US-20250092038-A1 AZAINDOLE ROCK INHIBITORS AVICENNA BIOSCIENCES, INC. (US) 2025-03-20 US disclosed
EP-4139286-B1 SUBSTITUTED AMINOTHIAZOLES AS DGKZETA INHIBITORS FOR IMMUNE ACTIVATION BAYER AG (DE) 2025-02-26 EP disclosed
WO-2024249380-A2 1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-AMINES AS ANTI-INFECTIOUS AGENTS UNIVERSITY OF VERMONT AND STATE AGRICULTURAL COLLEGE (US) 2024-12-05 WO disclosed
WO-2024145569-A2 AZAINDOLE ROCK INHIBITORS AVICENNA BIOSCIENCES, INC. (US) 2024-07-04 WO disclosed
CN-117098767-A METTL3 modulators 埃克森特治疗公司 2023-11-21 CN disclosed
US-20230365546-A1 5-SUBSTITUTED INDOLE 3-AMIDE DERIVATIVES, PREPARATION METHOD AND USE THEREOF ORIGIANT PHARMACEUTICAL CO., LTD (CN) 2023-11-16 US disclosed
EP-4212525-A1 5-SUBSTITUTED INDOLE 3-AMIDE DERIVATIVE, PREPARATION METHOD AND USE THEREOF Origiant Pharmaceutical Co., Ltd (CN) 2023-07-19 EP disclosed
WO-2023018472-A9 AMINOARYL-INTEGRIN AGONISTS COMPOUNDS TEXAS HEART INSTITUTE (US) 2023-07-13 WO disclosed
US-20230167078-A1 SUBSTITUTED AMINOTHIAZOLES AS DGKZETA INHIBITORS FOR IMMUNE ACTIVATION BAYER AKTIENGESELLSCHAFT (DE) 2023-06-01 US disclosed
CN-116082435-A Dipeptide and tripeptide immunoproteasome inhibitor and preparation method and pharmaceutical application thereof 中国医学科学院药物研究所 2023-05-09 CN disclosed
US-20230139936-A1 SUBSTITUTED AMINOTHIAZOLES AS DGKZETA INHIBITORS FOR IMMUNE ACTIVATION BAYER AKTIENGESELLSCHAFT (DE) 2023-05-04 US disclosed
WO-2023018472-A1 AMINOARYL-INTEGRIN AGONISTS COMPOUNDS TEXAS HEART INSTITUTE (US) 2023-02-16 WO disclosed
US-20220388998-A1 RHO KINASE INHIBITORS AND COMPOSITIONS AND METHODS OF USE THEREOF CHDI FOUNDATION, INC. 2022-12-08 US disclosed
WO-2022187809-A1 TLR7 AND TLR8 AGONISTS FOR THE TREATMENT OF CANCER AND/OR INFECTIOUS DISEASES THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2022-09-09 WO 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 (8 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-12428413-B2 Rho kinase inhibitors and compositions and methods of use thereof ROCK1, ROCK2, RHOA TAAR1 4452/4885MAOB 775/4885IDO1 3978/4885
US-20230139936-A1 SUBSTITUTED AMINOTHIAZOLES AS DGKZETA INHIBITORS FOR IMMUNE ACTIVATION DGKZ, DGKA, DGKG TAAR1 3075/4885MAOB 4044/4885IDO1 1682/4885
US-12415805-B2 Azaindole rock inhibitors ROCK2, ROCK1, ARHGDIA TAAR1 3522/4885MAOB 2468/4885IDO1 1967/4885
US-20230365546-A1 5-SUBSTITUTED INDOLE 3-AMIDE DERIVATIVES, PREPARATION METHOD AND USE THEREOF RIPK1, RIPK3, RIPK2 TAAR1 1865/4885MAOB 1929/4885IDO1 10/4885
US-20230167078-A1 SUBSTITUTED AMINOTHIAZOLES AS DGKZETA INHIBITORS FOR IMMUNE ACTIVATION DGKZ, DGKA, DGKG TAAR1 3075/4885MAOB 4044/4885IDO1 1682/4885
US-20220388998-A1 RHO KINASE INHIBITORS AND COMPOSITIONS AND METHODS OF USE THEREOF ROCK1, ROCK2, RHOA TAAR1 4452/4885MAOB 775/4885IDO1 3978/4885
US-20260116879-A1 AZAINDOLE ROCK INHIBITORS PRKG2, PRKG1, ROCK2 TAAR1 1784/4885MAOB 1428/4885IDO1 2524/4885
US-20250092038-A1 AZAINDOLE ROCK INHIBITORS ROCK2, ROCK1, ARHGDIA TAAR1 3522/4885MAOB 2468/4885IDO1 1967/4885

“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.