SCHEMBL496725

SCHEMBL496725

O=S(=O)(O)Cc1ccncc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 2/20 0.48
ALDH1A1 P00352 3/20 0.42
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
HSD17B10 Q99714 1/20 0.41
LMNA P02545 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
FDPS P14324 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NPC1 O15118 1/20 0.39
KMT2A Q03164 1/20 0.39
NAMPT P43490 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
HTT P42858 1/20 0.38
CA2 P00918 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
SCHEMBL9538094 0.98 LOXL2 (0.46) LOXL2ALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL9478965 0.98 LOXL2 (0.46) LOXL2ALDH1A1CYP1A2CYP3A4CYP2D6
Hydrochloric Acid SCHEMBL27648326 0.90 LOXL2 (0.40) LOXL2ALDH1A1CYP1A2CYP3A4CYP2D6
Hydrochloric Acid SCHEMBL10417772 0.84 CHKA (0.39) LOXL2ALDH1A1LMNASMN1; SMN2MAPT
Phenylmethanesulfonic Acid SCHEMBL3538486 0.83 CA1 (0.47) ALDH1A1HSD17B10LMNASMN1; SMN2MAPT
SCHEMBL8474031 0.82 CA2 (0.41) CYP1A2CYP2D6HSD17B10SMN1; SMN2MAPT
SCHEMBL28476775 0.80 LOXL2 (0.46) LOXL2ALDH1A1CYP1A2CYP3A4CYP2D6
Sulfuric Acid SCHEMBL9494104 0.79 LOXL2 (0.73) LOXL2ALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL819155 0.77 KMT2A (0.53) LOXL2ALDH1A1LMNASMN1; SMN2L3MBTL1
Pyridine SCHEMBL31212672 0.77 KMT2A (0.46) ALDH1A1CYP3A4LMNASMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112679967-A Novel active antibacterial food packaging material and preparation method thereof 温州乐成塑业有限公司 2021-04-20 CN claimed
EP-2578577-A1 Sulfonyl esters of tetrahydrocannabinol and derivatives thereof Albany Molecular Research, Inc. (US) 2013-04-10 EP claimed
US-7674922-B2 Process for production of delta-9-tetrahydrocannabinol ALBANY MOLECULAR RESEARCH, INC. (US) 2010-03-09 US claimed
EP-1928853-A2 PROCESS FOR PRODUCTION OF DELTA-9-TETRAHYDROCANNABINOL AMR Technology, Inc. (US) 2008-06-11 EP claimed
US-20070093665-A1 Process for production of delta-9- tetrahydrocannabinol AMR TECHNOLOGY, INC. (US) 2007-04-26 US claimed
WO-2007041167-A2 PROCESS FOR PRODUCTION OF DELTA-9-TETRAHYDROCANNABINOL AMR TECHNOLOGY, INC. (US) 2007-04-12 WO claimed
WO-2023183613-A2 INDOLIZINE COMPOUNDS FOR THE TREATMENT OF MENTAL DISORDERS OR INFLAMMATION TACTOGEN INC (US) 2023-09-28 WO disclosed
CN-112679967-A Novel active antibacterial food packaging material and preparation method thereof 温州乐成塑业有限公司 2021-04-20 CN disclosed
CN-105555780-B SYK inhibitors 吉利德科学公司 2018-01-23 CN disclosed
CN-104119242-A Improved amino lipids and methods for the delivery of nucleic acids TEKMIRA PHARMACEUTICALS CORP 2014-10-29 CN disclosed
CN-102245590-B Improved amino lipids and methods of delivering nucleic acids TEKMIRA PHARMACEUTICALS CORP 2014-03-19 CN disclosed
EP-2578561-A1 Processes for the production of cannabidiol derivatives and intermediates thereof Albany Molecular Research, Inc. (US) 2013-04-10 EP disclosed
EP-2578577-A1 Sulfonyl esters of tetrahydrocannabinol and derivatives thereof Albany Molecular Research, Inc. (US) 2013-04-10 EP disclosed
EP-1928853-A2 PROCESS FOR PRODUCTION OF DELTA-9-TETRAHYDROCANNABINOL AMR Technology, Inc. (US) 2008-06-11 EP disclosed
US-20070093665-A1 Process for production of delta-9- tetrahydrocannabinol AMR TECHNOLOGY, INC. (US) 2007-04-26 US disclosed
WO-2007041167-A2 PROCESS FOR PRODUCTION OF DELTA-9-TETRAHYDROCANNABINOL AMR TECHNOLOGY, INC. (US) 2007-04-12 WO disclosed
CN-1276917-C Method for synthesizing compound in condensed carbonyl group BAIHUA PERFUME CO LTD GUANGZHO (CN) 2006-09-27 CN disclosed
CN-1562998-A Method for synthesizing compound in condensed carbonyl group BAIHUA PERFUME CO LTD GUANGZHO (CN) 2005-01-12 CN disclosed
US-4952397-A HAVING PYRIDINIUM GROUP; ADMINISTERED WITH A DEHYDROPEPTIDASE INHIBITOR MERCK & CO., INC. (US) 1990-08-28 US disclosed
EP-0376355-A1 2-Quaternary heteroarylalkythio carbapenems MERCK & CO. INC. (US) 1990-07-04 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 (1 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-20070093665-A1 Process for production of delta-9- tetrahydrocannabinol CNR2, CNR1, HRH4 LOXL2 2392/4885ALDH1A1 2849/4885CYP1A2 753/4885

“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.