SCHEMBL5845169

SCHEMBL5845169

O=C1SCc2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 3/20 1.00
▸ MAOA P21397 4/20 0.44
▸ CES1 P23141 2/20 0.44
▸ MAOB P27338 3/20 0.41
▸ S100A4 P26447 1/20 0.41
▸ BCHE P06276 1/20 0.41
▸ AKR1B1 P15121 1/20 0.41
▸ CA12 O43570 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ IDO1 P14902 1/20 0.40
▸ CDC25B P30305 1/20 0.40
▸ AKT1 P31749 1/20 0.40
▸ SNCA P37840 1/20 0.40
▸ MAP2K1 Q02750 1/20 0.40
▸ PIN1 Q13526 1/20 0.40
▸ EHMT2 Q96KQ7 1/20 0.40
▸ NSD1 Q96L73 1/20 0.40
▸ EHMT1 Q9H9B1 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ CYP2A6 P11509 1/20 0.40

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
SCHEMBL25385438 0.91 ACHE (0.83) ACHEMAOACES1MAOBS100A4
SCHEMBL10778357 0.90 ACHE (0.81) ACHEMAOACES1MAOBS100A4
SCHEMBL1254053 0.77 ACHE (0.63) ACHEMAOACES1MAOBS100A4
SCHEMBL13190451 0.76 ACHE (0.61) ACHEMAOACES1MAOBS100A4
SCHEMBL5258883 0.74 ACHE (0.59) ACHEMAOACES1MAOBS100A4
SCHEMBL86279 0.74 ACHE (0.59) ACHEMAOACES1MAOBS100A4
SCHEMBL31510701 0.74 ACHE (0.59) ACHEMAOACES1MAOBS100A4
SCHEMBL31123671 0.74 ACHE (0.59) ACHEMAOACES1MAOBS100A4
SCHEMBL22271438 0.74 ACHE (0.59) ACHEMAOAMAOBCA9KMT2A
SCHEMBL22271588 0.74 ACHE (0.59) ACHEMAOBS100A4CA9KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12637410-B2 Vesicular monoamine transporter-2 ligands and their use in the treatment of psychostimulant abuse UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2026-05-26 — — US claimed
WO-2025122555-A1 S1P 1 RECEPTOR AGONISTS AND USES THEREOF VALO HEALTH, INC. (US) 2025-06-12 — — WO claimed
WO-2023245156-A2 VESICULAR MONOAMINE TRANSPORTER-2 LIGANDS AND THEIR USE IN THE TREATMENT OF PSYCHOSTIMULANT ABUSE UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2023-12-21 — — WO claimed
US-20220315523-A1 Vesicular Monoamine Transporter-2 Ligands and Their Use in the Treatment of Psychostimulant Abuse UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2022-10-06 — — US claimed
US-12637410-B2 Vesicular monoamine transporter-2 ligands and their use in the treatment of psychostimulant abuse UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2026-05-26 — — US disclosed
EP-4727548-A1 METHOD OF TREATING CANCER WITH INDOLINE INHIBITORS OF KIF18A Volastra Therapeutics, Inc. (US) 2026-04-22 — — EP disclosed
US-20260098018-A1 BICYCLIC 1,4-DIAZEPANONES AND THERAPEUTIC USES THEREOF CYTOKINETICS INC (US) 2026-04-09 — — US disclosed
US-20250368654-A1 HETEROCYCLIC INHIBITORS OF ENPP1 VOLASTRA THERAPEUTICS, INC. (US) 2025-12-04 — — US disclosed
EP-4638433-A1 NAMPT MODULATORS Cytokinetics, Inc. (US) 2025-10-29 — — EP disclosed
US-12441691-B2 Bicyclic 1,4-diazepanones and therapeutic uses thereof CYTOKINETICS, INC. (US) 2025-10-14 — — US disclosed
US-20250296916-A1 BICYCLIC PIPERAZINONES AND THERAPEUTIC USES THEREOF CYTOKINETICS, INC. 2025-09-25 — — US disclosed
US-20250276976-A1 CARDIAC SARCOMERE INHIBITORS CYTOKINETICS, INC. 2025-09-04 — — US disclosed
EP-0707023-A1 Method for the preparation of a heterocyclic polymer DSM N.V. (NL) 1996-04-17 — — EP disclosed
US-4867781-A PRE- AND POSTEMERGENCE HERBICIDES; NONPHYTOTOXIC E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-09-19 — — US disclosed
US-4802911-A HERBICIDES, PLANT GROWTH REGULATORS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-02-07 — — US disclosed
EP-0107979-B1 NOVEL PHENYL-SUBSTITUTED SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1988-10-12 — — EP disclosed
US-4741761-A HERBICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-05-03 — — US disclosed
US-4620870-A HERBICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1986-11-04 — — US disclosed
US-4586950-A HERBICIDES E. I. DU PONT DE NEMOURS & COMPANY (US) 1986-05-06 — — US disclosed
EP-0107979-A1 Novel phenyl-substituted sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-05-09 — — 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-20250296916-A1 BICYCLIC PIPERAZINONES AND THERAPEUTIC USES THEREOF MYLK2, TNNI3, TNNC1 ACHE 2931/4885MAOA 4410/4885CES1 2501/4885
US-20250276976-A1 CARDIAC SARCOMERE INHIBITORS TNNI3, MYLK2, TNNT2 ACHE 3200/4885MAOA 1555/4885CES1 3083/4885
US-12637410-B2 Vesicular monoamine transporter-2 ligands and their use in the treatment of psychostimulant abuse SLC18A2, SLC6A2, SLC6A3 ACHE 1656/4885MAOA 420/4885CES1 355/4885
US-12441691-B2 Bicyclic 1,4-diazepanones and therapeutic uses thereof MYLK2, MUSK, MYLK ACHE 942/4885MAOA 2894/4885CES1 2297/4885
US-20250368654-A1 HETEROCYCLIC INHIBITORS OF ENPP1 ENPP1, ENPP3, ENPP2 ACHE 1398/4885MAOA 1192/4885CES1 303/4885
US-20260098018-A1 BICYCLIC 1,4-DIAZEPANONES AND THERAPEUTIC USES THEREOF MYLK2, TNNT2, RYR1 ACHE 828/4885MAOA 3043/4885CES1 1014/4885
US-20220315523-A1 Vesicular Monoamine Transporter-2 Ligands and Their Use in the Treatment of Psychostimulant Abuse SLC18A2, SLC6A2, SLC6A3 ACHE 1019/4885MAOA 126/4885CES1 1018/4885

“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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