SCHEMBL680551

SCHEMBL680551

NC1C(O)=Cc2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
GAA P10253 1/20 0.38
KMT2A Q03164 1/20 0.38
HTR2A P28223 2/20 0.37
ANPEP P15144 2/20 0.32

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
SCHEMBL30181026 1.00 MEN1 (0.38) MEN1GAAKMT2AHTR2AANPEP
SCHEMBL17343612 1.00 MEN1 (0.38) MEN1GAAKMT2AHTR2AANPEP
SCHEMBL680550 1.00 MEN1 (0.38) MEN1GAAKMT2AHTR2AANPEP
SCHEMBL30272955 0.96 MEN1 (0.35) MEN1GAAKMT2AHTR2AANPEP
SCHEMBL30272956 0.76 CYP1A2 (0.38) MEN1KMT2A
SCHEMBL5111850 0.75 MEN1 (0.33) MEN1GAAKMT2AHTR2A
SCHEMBL30424597 0.74 HTR2A (0.38) MEN1GAAKMT2AHTR2AANPEP
SCHEMBL8531996 0.74 MAOA (0.38) MEN1GAAKMT2AHTR2A
SCHEMBL24475199 0.73 MEN1 (0.33) MEN1GAAKMT2AHTR2A
SCHEMBL6237164 0.73 MEN1 (0.33) MEN1GAAKMT2AHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116396189-B Preparation method of (S) - (+) -1-indanyl isocyanate 无锡科华生物科技有限公司 2024-11-05 CN claimed
CN-116396189-A Preparation method of (S) - (+) -1-indanyl isocyanate 无锡科华生物科技有限公司 2023-07-07 CN claimed
CN-122094834-A Resin composition for three-dimensional printing 2026-05-26 CN disclosed
EP-4734985-A1 PREVENTION, INHIBITION OR TREATMENT OF CONDITIONS OR DISORDERS MEDIATED BY UROCANATE REDUCTASE IMPLEXION PHARMA AB (SE) 2026-05-06 EP disclosed
US-12616193-B2 5-(1H-indol-3-yl)-oxazole, -oxadiazole and -furan derivatives as enhancers of sperm motility SPERMATECH AS (NO) 2026-05-05 US disclosed
US-12472168-B2 Ring-fused thiazolino 2-pyridones, methods for preparation thereof and their use in the treatment and/or prevention of a disease involving gram-positive bacteria QURETECH BIO AB (SE) 2025-11-18 US disclosed
CN-119751905-A Bio-based hyperbranched epoxy resin-bisphenol A type epoxy resin composite resin containing hexahydro-s-triazine structure and preparation method thereof 中南民族大学 2025-04-04 CN disclosed
WO-2025003469-A1 PREVENTION, INHIBITION OR TREATMENT OF CONDITIONS OR DISORDERS MEDIATED BY UROCANATE REDUCTASE IMPLEXION PHARMA AB (SE) 2025-01-02 WO disclosed
CN-116396189-B Preparation method of (S) - (+) -1-indanyl isocyanate 无锡科华生物科技有限公司 2024-11-05 CN disclosed
CN-116396189-B Preparation method of (S) - (+) -1-indanyl isocyanate 无锡科华生物科技有限公司 2024-11-05 CN disclosed
EP-4448525-A1 PYRIMIDINE-ANNULATED TRIAZOLE DERIVATIVES AND THEIR USE IN PLATELET AGGREGATION INHIBITION Beijing Honghui Meditech Co., Ltd. (CN) 2024-10-23 EP disclosed
US-7582629-B2 Derivatives of isothiazol-3(2H)-one 1,1-dioxides as liver X receptor modulators ASTRAZENECA AB (SE) 2009-09-01 US disclosed
CN-101511839-A Fungicidal azolopyrimidines, methods for the production thereof, use thereof for controlling harmful fungi, and substances containing the same BASF SE (DE) 2009-08-19 CN disclosed
US-20090029945-A2 Non-Anilinic Derivatives of Isothiazol-3(2H)-Thione 1,1-Dioxides As Liver X Receptor Modulators ASTRAZENECA AB (SE) 2009-01-29 US disclosed
US-20090005353-A1 Non-Anilinic Derivatives of Isothiazol-3(2H)-one 1,1-Dioxides as Liver X Receptor Modulators ASTRAZENECA AB (SE) 2009-01-01 US disclosed
US-20080319017-A2 Non-Anilinic Derivatives of Isothiazol-3(2H)-Thione 1,1-Dioxides As Liver X Receptor Modulators ASTRAZENECA AB (SE) 2008-12-25 US disclosed
US-20080255122-A1 Derivatives of Isothiazol-3(2H)-One 1,1-Dioxides as Liver X Receptor Modulators ASTRAZENECA AB (SE) 2008-10-16 US disclosed
US-20080139616-A1 Atherosclerosis; inflammatory diseases, Alzheimer's disease, dyslipidemia, metabolic syndrome; 2-isopropyl-5-phenyl-4-[(4-phenylbutyl)amino]isothiazole-3(2H)-thione 1,1-dioxide for example ASTRAZENECA AB (SE) 2008-06-12 US disclosed
US-20080125396-A1 Derivatives of Isothiazol-3(2H)-Thione 1,1-Dioxides as Liver X Receptor Modulators ATRAZENECA AB (SE) 2008-05-29 US disclosed
CN-1809529-A Pharmaceutically acceptable salts of carboxylic acid derivatives ASTRAZENECA AB (SE) 2006-07-26 CN 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-20080125396-A1 Derivatives of Isothiazol-3(2H)-Thione 1,1-Dioxides as Liver X Receptor Modulators NR1H2, NR1H3, NR1I2 MEN1 4391/4885GAA 3174/4885KMT2A 3218/4885
US-20090005353-A1 Non-Anilinic Derivatives of Isothiazol-3(2H)-one 1,1-Dioxides as Liver X Receptor Modulators NR1H2, NR1H3, NR1I2 MEN1 4332/4885GAA 2135/4885KMT2A 2880/4885
US-12616193-B2 5-(1H-indol-3-yl)-oxazole, -oxadiazole and -furan derivatives as enhancers of sperm motility NR5A1, CATSPER1, HCN3 MEN1 4620/4885GAA 4816/4885KMT2A 4007/4885
US-20080319017-A2 Non-Anilinic Derivatives of Isothiazol-3(2H)-Thione 1,1-Dioxides As Liver X Receptor Modulators NR1H2, NR1H3, NR1I2 MEN1 4395/4885GAA 2805/4885KMT2A 3100/4885
US-20080139616-A1 Atherosclerosis; inflammatory diseases, Alzheimer's disease, dyslipidemia, metabolic syndrome; 2-isopropyl-5-phenyl-4-[(4-phenylbutyl)amino]isothiazole-3(2H)-thione 1,1-dioxide for example NR1H2, NR1H3, SREBF1 MEN1 4650/4885GAA 2556/4885KMT2A 3177/4885
US-12472168-B2 Ring-fused thiazolino 2-pyridones, methods for preparation thereof and their use in the treatment and/or prevention of a disease involving gram-positive bacteria NOD2, TLR4, TLR5 MEN1 1068/4885GAA 251/4885KMT2A 3896/4885
US-20090029945-A2 Non-Anilinic Derivatives of Isothiazol-3(2H)-Thione 1,1-Dioxides As Liver X Receptor Modulators NR1H2, NR1H3, NR1I2 MEN1 4395/4885GAA 2805/4885KMT2A 3100/4885
US-20080255122-A1 Derivatives of Isothiazol-3(2H)-One 1,1-Dioxides as Liver X Receptor Modulators NR1H2, NR1H3, NR1I2 MEN1 4112/4885GAA 2454/4885KMT2A 3198/4885

“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.