SCHEMBL2297876

SCHEMBL2297876

NCCCN1CCC(O)CC1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
KCNA3 P22001 1/20 0.42
SPHK1 Q9NYA1 1/20 0.41
SIGMAR1 Q99720 1/20 0.40
ALOX15 P16050 1/20 0.40
CYP2D6 P10635 1/20 0.40
ARG1 P05089 2/20 0.40
ARG2 P78540 2/20 0.40
HRH3 Q9Y5N1 2/20 0.40
HRH2 P25021 1/20 0.40
HRH1 P35367 1/20 0.40
ACHE P22303 1/20 0.40
DPP7 Q9UHL4 2/20 0.39
GNAI3 P08754 1/20 0.38
GNAO1 P09471 1/20 0.38
GNAI1 P63096 1/20 0.38
SLC6A4 P31645 1/20 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
SCHEMBL26493965 0.93 KEAP1 (0.43) KEAP1SMN1; SMN2KCNA3SPHK1SIGMAR1
SCHEMBL26494009 0.91 SLC6A4 (0.46) KEAP1SMN1; SMN2KCNA3SPHK1SIGMAR1
SCHEMBL26493993 0.91 SLC6A4 (0.46) KEAP1SMN1; SMN2KCNA3SPHK1SIGMAR1
Oxalic Acid SCHEMBL9345679 0.90 ARG1 (0.44) KEAP1SMN1; SMN2KCNA3SIGMAR1CYP2D6
SCHEMBL12279922 0.87 PDCD1 (0.44) KEAP1SMN1; SMN2KCNA3HRH3HRH2
SCHEMBL2674136 0.87 PDCD1 (0.44) KEAP1SMN1; SMN2KCNA3HRH3HRH2
SCHEMBL12280022 0.87 PDCD1 (0.44) KEAP1SMN1; SMN2KCNA3HRH3HRH2
SCHEMBL722623 0.86 ALOX15 (0.57) KCNA3SPHK1ALOX15ARG1ARG2
Hydrochloric Acid SCHEMBL2673579 0.85 PDCD1 (0.43) KEAP1SMN1; SMN2HRH3HRH2HRH1
Hydrochloric Acid SCHEMBL5107700 0.84 ALOX15 (0.55) KCNA3SPHK1ALOX15ARG1ARG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118546359-A Method for upgrading and recycling polycaprolactone 南昌大学 2024-08-27 CN claimed
CN-118546359-A Method for upgrading and recycling polycaprolactone 南昌大学 2024-08-27 CN disclosed
CN-118317944-A Acyclic lipids and methods of use thereof 雷纳嘉德医疗管理公司 2024-07-09 CN disclosed
CN-118234707-A Cyclic lipids and methods of use thereof 雷纳嘉德医疗管理公司 2024-06-21 CN disclosed
WO-2023196444-A1 IONIZABLE CATIONIC LIPIDS AND LIPID NANOPARTICLES CAPSTAN THERAPEUTICS, INC. (US) 2023-10-12 WO disclosed
US-20230320995-A1 IONIZABLE CATIONIC LIPIDS AND LIPID NANOPARTICLES CAPSTAN THERAPEUTICS, INC. (US) 2023-10-12 US disclosed
US-20230320995-A1 IONIZABLE CATIONIC LIPIDS AND LIPID NANOPARTICLES CAPSTAN THERAPEUTICS, INC. (US) 2023-10-12 US disclosed
US-20220388962-A1 MOLECULES THAT BIND TO TDP-43 FOR THE TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS AND RELATED DISORDERS FOX CHASE CHEMICAL DIVERSITY CENTER INC. 2022-12-08 US disclosed
EP-4017492-A1 MOLECULES THAT BIND TO TDP-43 FOR THE TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS AND RELATED DISORDERS Biohaven Therapeutics Ltd. (US) 2022-06-29 EP disclosed
CN-114667145-A Molecules that bind to TDP-43 for the treatment of amyotrophic lateral sclerosis and related disorders 拜尔哈文制药股份有限公司 2022-06-24 CN disclosed
US-20060004029-A1 Nitrogen-containing aromatic derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2006-01-05 US disclosed
CN-1678607-A Nitrogen-containing aromatic ring derivatives EISAI CO LTD (JP) 2005-10-05 CN disclosed
US-20050187236-A1 Nitrogen-containing aromatic derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-08-25 US disclosed
EP-1522540-A1 AZAARENE DERIVATIVES Eisai Co., Ltd. (JP) 2005-04-13 EP disclosed
EP-0366004-B1 Cyclic azaaliphatic compounds with a nitroxy group, process for their preparation and pharmaceutical compositions thereof BOEHRINGER MANNHEIM GMBH (DE) 1994-03-30 EP disclosed
US-4585869-A ANTIINFLAMMATORY, ANALGESIC, ANTIULCER ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1986-04-29 US disclosed
US-4549023-A ANTINFLAMMATORY AGENTS, ANALGESICS ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1985-10-22 US disclosed
EP-0049779-B1 3-AMINOINDAZOLE DERIVATIVES AND PROCESS FOR PREPARATION THEREOF Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1984-10-31 EP disclosed
US-4474964-A 3-Aminoindazole derivatives ASAHI, KASEI, KOGYO, KABUSHIKI, KAISHA (JP) 1984-10-02 US disclosed
EP-0049779-A1 3-Aminoindazole derivatives and process for preparation thereof Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1982-04-21 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 (4 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-20220388962-A1 MOLECULES THAT BIND TO TDP-43 FOR THE TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS AND RELATED DISORDERS TARDBP, TDP1, TDP2 KEAP1 1040/4885SMN1; SMN2 87/4885KCNA3 3680/4885
US-20060004029-A1 Nitrogen-containing aromatic derivatives NR0B2, NR0B1, NR4A1 KEAP1 2868/4885SMN1; SMN2 3950/4885KCNA3 1315/4885
US-20230320995-A1 IONIZABLE CATIONIC LIPIDS AND LIPID NANOPARTICLES PLTP, LNPEP, PLIN3 KEAP1 4175/4885SMN1; SMN2 2768/4885KCNA3 2950/4885
US-20050187236-A1 Nitrogen-containing aromatic derivatives NR0B2, NR0B1, NR4A1 KEAP1 2868/4885SMN1; SMN2 3950/4885KCNA3 1315/4885

“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.