SCHEMBL442095

SCHEMBL442095

Cc1cc(C)c(N2C=[N+](c3c(C)cc(C)cc3C)CC2)c(C)c1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HRH3 Q9Y5N1 1/20 0.30

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
Bromide SCHEMBL1608734 0.98 ALDH1A1 (0.32) ALDH1A1POLBMAPTHTTSMN1; SMN2
Hydrochloric Acid SCHEMBL442699 0.98 ALDH1A1 (0.32) ALDH1A1POLBMAPTHTTSMN1; SMN2
SCHEMBL819057 0.93
SCHEMBL18287206 0.92
SCHEMBL29603795 0.89 ALDH1A1 (0.34) ALDH1A1POLBMAPTHTTSMN1; SMN2
SCHEMBL29603410 0.88 ALDH1A1 (0.33) ALDH1A1POLBMAPTHTTSMN1; SMN2
Bromide SCHEMBL4539689 0.88 ALDH1A1 (0.33) ALDH1A1POLBMAPTHTTSMN1; SMN2
SCHEMBL21722392 0.88 ALDH1A1 (0.33) ALDH1A1POLBMAPTHTTSMN1; SMN2
Hydrochloric Acid SCHEMBL17783834 0.84 L3MBTL1 (0.30)
SCHEMBL6098447 0.84 ALDH1A1 (0.31) ALDH1A1POLBMAPTHTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250109115-A1 METHOD FOR PREPARING A CYCLIC ANHYDRIDE FROM AN UNSATURATED CARBOXYLIC ACID COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2025-04-03 US claimed
WO-2025045850-A1 METHOD FOR PREPARING HYDROBORANES BY HYDROGENOLYSIS OF (PSEUDO-)HALOBORANES COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2025-03-06 WO claimed
EP-4430033-A1 METHOD FOR PREPARING A CYCLIC ANHYDRIDE FROM AN UNSATURATED CARBOXYLIC ACID Commissariat à l'énergie atomique et aux énergies alternatives (FR) 2024-09-18 EP claimed
US-11912731-B2 Use of silylated formiates as hydrosilane equivalents COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2024-02-27 US claimed
WO-2023083828-A1 METHOD FOR PREPARING A CYCLIC ANHYDRIDE FROM AN UNSATURATED CARBOXYLIC ACID COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2023-05-19 WO claimed
US-20210292345-A1 Use of Silylated Formiates as Hydrosilane Equivalents COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2021-09-23 US claimed
US-11084777-B2 Method for preparing alkylamines COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2021-08-10 US claimed
EP-3374363-B1 METHOD FOR PREPARING METHOXYBORANES AND FOR PRODUCING METHANOL COMMISSARIAT ENERGIE ATOMIQUE (FR) 2020-04-01 EP claimed
EP-3507292-A1 USE OF SILYLATED FORMIATES AS HYDROSILANE EQUIVALENTS Commissariat à l'Énergie Atomique et aux Énergies Alternatives (FR) 2019-07-10 EP claimed
US-20190084917-A1 Method for Preparting Alkylamines COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2019-03-21 US claimed
EP-2803356-A1 Method for treating neurological disorders with imidazolium and imidazolinium compounds Agency for Science, Technology and Research (SG) 2014-11-19 EP claimed
US-8877971-B2 Method for preparing formamide compounds COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2014-11-04 US claimed
EP-2694469-A2 METHOD FOR PREPARING FORMAMIDE COMPOUNDS Commissariat à l'Énergie Atomique et aux Énergies Alternatives (FR) 2014-02-12 EP claimed
US-20140018576-A1 Method for Preparing Formamide Compounds COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2014-01-16 US claimed
WO-2013182991-A1 METHOD FOR PREPARING METHYLATED AMINES COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2013-12-12 WO claimed
WO-2012137152-A2 METHOD FOR PREPARING FORMAMIDE COMPOUNDS COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2012-10-11 WO claimed
US-20110178040-A1 METHOD FOR TREATING FIBROSIS AND CANCER WITH IMIDAZOLIUM AND IMIDAZOLINIUM COMPOUNDS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2011-07-21 US claimed
US-20110028513-A1 METHOD FOR TREATING NEUROLOGICAL DISORDERS WITH IMIDAZOLIUM AND IMIDAZOLINIUM COMPOUNDS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2011-02-03 US claimed
EP-2271338-A1 METHOD FOR TREATING NEUROLOGICAL DISORDERS WITH IMIDAZOLIUM AND IMIDAZOLINIUM COMPOUNDS Agency for Science, Technology And Research (SG) 2011-01-12 EP claimed
WO-2009123569-A1 METHOD FOR TREATING NEUROLOGICAL DISORDERS WITH IMIDAZOLIUM AND IMIDAZOLINIUM COMPOUNDS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2009-10-08 WO claimed

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-20210292345-A1 Use of Silylated Formiates as Hydrosilane Equivalents PFAS, EPM2A, CYP2F1 ALDH1A1 112/4885POLB 2521/4885MAPT 666/4885
US-20110028513-A1 METHOD FOR TREATING NEUROLOGICAL DISORDERS WITH IMIDAZOLIUM AND IMIDAZOLINIUM COMPOUNDS SMN1; SMN2, INA, NLN ALDH1A1 2486/4885POLB 4811/4885MAPT 76/4885
US-11912731-B2 Use of silylated formiates as hydrosilane equivalents PFAS, EPM2A, CYP2F1 ALDH1A1 112/4885POLB 2521/4885MAPT 666/4885
US-20110178040-A1 METHOD FOR TREATING FIBROSIS AND CANCER WITH IMIDAZOLIUM AND IMIDAZOLINIUM COMPOUNDS MMP1, MYLK, MMP8 ALDH1A1 1225/4885POLB 4512/4885MAPT 4680/4885
US-11084777-B2 Method for preparing alkylamines ALKBH2, ACR, ALKBH1 ALDH1A1 880/4885POLB 1421/4885MAPT 3425/4885
US-20140018576-A1 Method for Preparing Formamide Compounds PFAS, F2, F8 ALDH1A1 511/4885POLB 1413/4885MAPT 1348/4885
US-20250109115-A1 METHOD FOR PREPARING A CYCLIC ANHYDRIDE FROM AN UNSATURATED CARBOXYLIC ACID CA7, CA6, ASIC1 ALDH1A1 823/4885POLB 3900/4885MAPT 3692/4885
US-20190084917-A1 Method for Preparting Alkylamines ALKBH2, ACR, ALKBH5 ALDH1A1 827/4885POLB 1025/4885MAPT 3566/4885

“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.