SCHEMBL708554

SCHEMBL708554

O=Cc1cc(Br)cc(Br)c1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.56
ERN1 O75460 4/20 0.41
CYP2A6 P11509 2/20 0.36
KDM4E B2RXH2 1/20 0.35
PTGS2 P35354 1/20 0.35
RAB9A P51151 1/20 0.35
MAOA P21397 2/20 0.33
MAOB P27338 2/20 0.33
ALDH1A3 P47895 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ALDH5A1 P51649 1/20 0.33
ABAT P80404 1/20 0.33
HSD17B3 P37058 1/20 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
SCHEMBL646947 0.94 ALDH1A1 (0.56) ALDH1A1ERN1CYP2A6KDM4EPTGS2
SCHEMBL613761 0.82 ALDH1A1 (0.46) ALDH1A1ERN1
SCHEMBL21169399 0.82 ALDH1A1 (0.46) ALDH1A1ERN1
SCHEMBL19234310 0.82 ALDH1A1 (0.46) ALDH1A1ERN1
SCHEMBL237896 0.82 ALDH1A1 (0.46) ALDH1A1ERN1HSD17B10
SCHEMBL13893901 0.82 ALDH1A1 (0.46) ALDH1A1ERN1
SCHEMBL668005 0.82 ALDH1A1 (0.46) ALDH1A1ERN1KDM4EPTGS2RAB9A
SCHEMBL1072176 0.82 ALDH1A1 (0.46) ALDH1A1ERN1
SCHEMBL1996468 0.82 ALDH1A1 (0.46) ALDH1A1ERN1CYP2A6ALDH1A3
SCHEMBL31039374 0.82 ALDH1A1 (0.46) ALDH1A1ERN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12234384-B2 Adhesion-improving composition for textile material and associated reinforcing textile material PORCHER INDUSTRIES (FR) 2025-02-25 US claimed
CN-116082591-B Preparation method and application of three-dimensional covalent organic framework 3D COF material based on 8-communicated cubic ligand 江苏科技大学 2025-02-25 CN claimed
CN-118652398-B Crown ether-based porous organic polymer and preparation method and application thereof 山东第二医科大学 2024-11-05 CN claimed
CN-118878455-A Electronic transmission material based on 4,2', 6',4' -terpyridine and preparation method and application thereof 电子科技大学 2024-11-01 CN claimed
CN-118420856-B Five-in-one combined antibacterial porphyrin cation covalent organic framework material and preparation method thereof 山东第二医科大学 2024-09-27 CN claimed
CN-118652398-A Crown ether-based porous organic polymer and preparation method and application thereof 山东第二医科大学 2024-09-17 CN claimed
CN-118459420-A Thiazolinone compound containing multiple halogen atoms and preparation method thereof 南京工业大学 2024-08-09 CN claimed
CN-118459422-A Thiazole thiazolinone compound containing multiple halogen atoms and preparation method thereof 南京工业大学 2024-08-09 CN claimed
CN-118420856-A Five-in-one combined antibacterial porphyrin cation covalent organic framework material and preparation method thereof 山东第二医科大学 2024-08-02 CN claimed
CN-118359536-A Novel-structure compound and application thereof in aspect of cryopreservation protection of stem cells 南京泓纬医药科技有限公司 2024-07-19 CN claimed
US-20090209596-A1 Oxazole Hydroxamic Acid Derivatives and Use Thereof SK HOLDINGS CO., LTD 2009-08-20 US claimed
EP-2056897-A1 MEDICAL STENT PROVIDED WITH A COMBINATION OF MELATONIN AND PACLITAXEL Blue Medical Devices B.V. (NL) 2009-05-13 EP claimed
US-20080142370-A1 Aqueous, Acidic Solution and Method for Electrolytically Depositing Copper Coatings as Well as Use of Said Solution ATOTECH DEUTSCHLAND GMBH (DE) 2008-06-19 US claimed
US-20080050413-A1 Medical stent provided with a combination of melatonin and paclitaxel BLUE MEDICAL DEVICES BV (NL) 2008-02-28 US claimed
WO-2008023038-A1 MEDICAL STENT PROVIDED WITH A COMBINATION OF MELATONIN AND PACLITAXEL BLUE MEDICAL DEVICES BV (NL) 2008-02-28 WO claimed
EP-1651801-B1 AQUEOUS, ACIDIC SOLUTION AND METHOD FOR ELECTROLYTICALLY DEPOSITING COPPER COATINGS AS WELL AS USE OF SAID SOLUTION ATOTECH DEUTSCHLAND GMBH (DE) 2008-01-23 EP claimed
EP-1841747-A1 OXAZOLE HYDROXAMIC ACID DERIVATIVES AND USE THEREOF SK Corporation (KR) 2007-10-10 EP claimed
WO-2006075888-A1 OXAZOLE HYDROXAMIC ACID DERIVATIVES AND USE THEREOF SK CORPORATION (KR) 2006-07-20 WO claimed
EP-1390336-A1 METHOD FOR PRODUCING AROMATIC ALDEHYDES AND KETONES BY THE CATALYTIC OXIDATION OF ALKYL-AROMATIC COMPOUNDS DSM Fine Chemicals Austria Nfg GmbH & Co KG (AT) 2004-02-25 EP claimed
WO-2002096849-A1 METHOD FOR PRODUCING AROMATIC ALDEHYDES AND KETONES BY THE CATALYTIC OXIDATION OF ALKYL-AROMATIC COMPOUNDS DSM FINE CHEMICALS AUSTRIA NFG GMBH & CO KG (AT) 2002-12-05 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 (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-20090209596-A1 Oxazole Hydroxamic Acid Derivatives and Use Thereof HDAC1, HDAC5, HDAC7 ALDH1A1 424/4885ERN1 3360/4885CYP2A6 2896/4885

“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.