SCHEMBL98306

SCHEMBL98306

Nc1ccc(Br)cc1-c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.54
HSD17B10 Q99714 1/20 0.54
MAPT P10636 4/20 0.47
POLB P06746 1/20 0.47
MAPK1 P28482 3/20 0.46
PTGDR2 Q9Y5Y4 1/20 0.45
IDO1 P14902 1/20 0.44
GPR35 Q9HC97 1/20 0.44
KDM4E B2RXH2 2/20 0.44
GLA P06280 2/20 0.44
MEN1 O00255 2/20 0.43
HTT P42858 2/20 0.43
KMT2A Q03164 2/20 0.43
AKR1C3 P42330 1/20 0.42
AKR1C2 P52895 1/20 0.42
AKR1C1 Q04828 1/20 0.42
PIM1 P11309 1/20 0.41
RAB9A P51151 1/20 0.41
PTPRC P08575 1/20 0.41
ACHE P22303 1/20 0.40

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
SCHEMBL29492487 1.00 ALDH1A1 (0.54) ALDH1A1HSD17B10MAPTPOLBMAPK1
SCHEMBL1027801 0.83 ALDH1A1 (0.54) ALDH1A1HSD17B10MAPTPOLBMAPK1
SCHEMBL5523993 0.83 ALDH1A1 (0.50) ALDH1A1HSD17B10MAPTPOLBMAPK1
SCHEMBL29573133 0.81 GPR35 (0.53) ALDH1A1MAPTPOLBMAPK1IDO1
SCHEMBL11518803 0.81 GPR35 (0.53) ALDH1A1MAPTPOLBMAPK1IDO1
SCHEMBL30006434 0.79 MAPK1 (0.52) ALDH1A1MAPTMAPK1PTGDR2KDM4E
SCHEMBL364027 0.79 MAPK1 (0.52) ALDH1A1MAPTMAPK1PTGDR2KDM4E
SCHEMBL19190198 0.79 PTPRC (0.56) ALDH1A1MAPTMAPK1PTGDR2KDM4E
SCHEMBL1321489 0.79 ALDH1A1 (0.61) ALDH1A1HSD17B10MAPTKDM4EMEN1
SCHEMBL5214073 0.79 IDO1 (0.42) ALDH1A1MAPTIDO1GPR35KDM4E

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
WO-2024109919-A1 PYRIDONE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF 盛睿泽华医药科技(苏州)有限公司 2024-05-30 WO disclosed
US-20230174485-A1 LIPOXYGENASE INHIBITORS SRI INTERNATIONAL (US) 2023-06-08 US disclosed
US-20230174485-A1 LIPOXYGENASE INHIBITORS SRI INTERNATIONAL (US) 2023-06-08 US disclosed
US-20230174485-A1 LIPOXYGENASE INHIBITORS SRI INTERNATIONAL (US) 2023-06-08 US disclosed
US-20230117592-A1 LIPOXYGENASE INHIBITORS SRI INTERNATIONAL (US) 2023-04-20 US disclosed
EP-4125874-A1 LIPOXYGENASE INHIBITORS SRI International (US) 2023-02-08 EP disclosed
CN-115335046-A Lipoxygenase inhibitors 思研(SRI)国际顾问与咨询公司 2022-11-11 CN disclosed
EP-4081199-A2 LIPOXYGENASE INHIBITORS SRI International (US) 2022-11-02 EP disclosed
CN-115135316-A Lipoxygenase inhibitors 思研(SRI)国际顾问与咨询公司 2022-09-30 CN disclosed
CN-112898352-B Asymmetric palladium complex, preparation method and application thereof in catalyzing olefin polymerization 中山大学 2022-03-22 CN disclosed
EP-1664065-A1 SILICON COMPOUNDS WITH MICROBIOCIDAL ACTIVITY Syngenta Participations AG (CH) 2006-06-07 EP disclosed
EP-1114052-B1 4-AMINOPYRROLOPYRIMIDINES AS KINASE INHIBITORS ABBOTT GMBH & CO KG (DE) 2005-11-16 EP disclosed
WO-2005028485-A1 SILICON COMPOUNDS WITH MICROBIOCIDAL ACTIVITY SYNGENTA PARTICIPATIONS AG (CH) 2005-03-31 WO disclosed
US-20030187001-A1 4-AMINOPYRROLOPYRIMIDINES AS KINASE INHIBITORS ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2003-10-02 US disclosed
CN-1326457-A 4-aminopyrrolopyrimidines as kinase inhibitors BASF AG (DE) 2001-12-12 CN disclosed
EP-1114052-A1 4-AMINOPYRROLOPYRIMIDINES AS KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2001-07-11 EP disclosed
WO-2000017202-A1 4-AMINOPYRROLOPYRIMIDINES AS KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2000-03-30 WO disclosed
US-4670566-A ANTIIFLAMMATORY AGENTS, ANTICOAGULANTS A. H. ROBINS COMPANY, INCORPORATED (US) 1987-06-02 US disclosed
US-4647560-A COGNITION ACTIVATORS TROPONWERKE GMBH & CO. KG (DE) 1987-03-03 US disclosed
US-4440785-A Methods of using 2-aminobiphenylacetic acids, esters, and metal salts thereof to treat inflammation A. H. ROBINS COMPANY, INC. (US) 1984-04-03 US 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 (3 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-20230117592-A1 LIPOXYGENASE INHIBITORS ALOX15B, ALOX12, ALOX5 ALDH1A1 203/4885HSD17B10 188/4885MAPT 2110/4885
US-20230174485-A1 LIPOXYGENASE INHIBITORS ALOX15B, ALOX12, ALOX15 ALDH1A1 133/4885HSD17B10 161/4885MAPT 1601/4885
US-20030187001-A1 4-AMINOPYRROLOPYRIMIDINES AS KINASE INHIBITORS LCK, PPP5C, DUSP1 ALDH1A1 1059/4885HSD17B10 3275/4885MAPT 2881/4885

“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.