SCHEMBL538121

SCHEMBL538121

CN(CCC#N)c1ccc(C=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.50
MAPT P10636 4/20 0.50
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
CYP2A6 P11509 2/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
CYP2A13 Q16696 1/20 0.50
ALDH3A1 P30838 1/20 0.47
ALDH1A3 P47895 1/20 0.47
GRK6 P43250 1/20 0.41
KDM4E B2RXH2 3/20 0.40
RXFP1 Q9HBX9 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
EGFR P00533 2/20 0.38

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
SCHEMBL10046157 0.86 MAPT (0.52) ALDH1A1MAPTMEN1KMT2ANPC1
SCHEMBL13306037 0.84 ALDH1A1 (0.46) ALDH1A1MAPTMEN1KMT2ANPC1
SCHEMBL13645995 0.83 CYP2A6 (0.64) ALDH1A1MAPTKMT2ACYP2A6CYP2A13
SCHEMBL18994843 0.83 ALDH1A1 (0.50) ALDH1A1MAPTMEN1KMT2ANPC1
SCHEMBL4698122 0.82 ALDH1A1 (0.55) ALDH1A1MAPTMEN1KMT2ACYP2A6
SCHEMBL11331207 0.82 CYP2A6 (0.53) ALDH1A1MAPTMEN1KMT2ACYP2A6
SCHEMBL8722764 0.81 ALDH1A1 (0.65) ALDH1A1MAPTMEN1KMT2ACYP2A6
SCHEMBL9836517 0.81 ALDH1A1 (0.53) ALDH1A1MAPTMEN1KMT2ACYP2A6
SCHEMBL10046156 0.80 ALDH1A1 (0.54) ALDH1A1MAPTMEN1KMT2ANPC1
SCHEMBL13645975 0.80 CYP2A6 (0.59) ALDH1A1MAPTMEN1KMT2ACYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12235217-B2 Diagnostic test kits for sample preparation and analysis SCANWELL HEALTH, INC. (US) 2025-02-25 US claimed
EP-4058775-A1 DIAGNOSTIC TEST KITS FOR SAMPLE PREPARATION AND ANALYSIS Scanwell Health, Inc. (US) 2022-09-21 EP claimed
CN-114981637-A Diagnostic test kit for sample preparation and analysis 斯肯威尔健康公司 2022-08-30 CN claimed
US-12617812-B2 Platinum(IV) complexes, methods of manufacture, compositions containing, and methods of use thereof CITY UNIVERSITY OF HONG KONG (HK) 2026-05-05 US disclosed
EP-4419206-B1 COMPOUNDS FOR THE TREATMENT OF MALARIA FUNDACIO INST DE BIOENGINYERIA DE CATALUNYA (ES) 2025-09-17 EP disclosed
US-20250258104-A1 DIAGNOSTIC TEST KITS FOR SAMPLE PREPARATION AND ANALYSIS SCANWELL HEALTH INC (US) 2025-08-14 US disclosed
US-12235217-B2 Diagnostic test kits for sample preparation and analysis SCANWELL HEALTH, INC. (US) 2025-02-25 US disclosed
US-20240415825-A1 COMPOUNDS FOR THE TREATMENT OF MALARIA Fundación Privada Instituto De Salud Global Barcelona (ES) 2024-12-19 US disclosed
EP-4419206-A1 COMPOUNDS FOR THE TREATMENT OF MALARIA Fundacio Institut de Bioenginyeria de Catalunya (ES) 2024-08-28 EP disclosed
CN-118475559-A Compounds for malaria treatment 加泰罗尼亚生物工程基金会研究所 2024-08-09 CN disclosed
US-11730055-B2 Dopant, charge transfer salt and organic electronic device CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2023-08-15 US disclosed
EP-0092698-A1 Process for the preparation of cationic methine dyes BAYER AG (DE) 1983-11-02 EP disclosed
US-4396767-A COLORS, CARBONLESS DUPLICATION STERLING DRUG INC. (US) 1983-08-02 US disclosed
US-4389474-A Thiopyrylium compounds and photoconductive compositions containing said compounds FUJI PHOTO FILM CO., LTD. (JP) 1983-06-21 US disclosed
EP-0074569-A2 Cationic methine dyes, process for their preparation and their use, in dyeing textile materials and other substrates BAYER AG (DE) 1983-03-23 EP disclosed
US-4363503-A FOR PRESSURE SENSITIVE CARBONLESS DUPLICATING AND THERMAL MARKING SYSTEMS STERLING DRUG INC. (US) 1982-12-14 US disclosed
EP-0061128-A1 Pyridine compounds, process for their preparation and systems containing them STERLING DRUG INC. (US) 1982-09-29 EP disclosed
US-3975379-A METHINE BAYER AKTIENGESELLSCHAFT (DT) 1976-08-17 US disclosed
US-3962220-A ONE-STEP, AROMATIC ALDEHYDES, ACETIC ACID E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-06-08 US disclosed
US-3962221-A CONDENSATION, REDUCTION, OXIDATION E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-06-08 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 (3 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-20240415825-A1 COMPOUNDS FOR THE TREATMENT OF MALARIA ABAT, GLS2, CPS1 ALDH1A1 2819/4885MAPT 24/4885MEN1 1686/4885
US-11730055-B2 Dopant, charge transfer salt and organic electronic device CHRM1, SLC6A3, DRD1 ALDH1A1 1969/4885MAPT 1286/4885MEN1 269/4885
US-12617812-B2 Platinum(IV) complexes, methods of manufacture, compositions containing, and methods of use thereof OGDH, C9, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 ALDH1A1 569/4885MAPT 4191/4885MEN1 1033/4885

“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.