SCHEMBL12355752

SCHEMBL12355752

Cc1cccc2nc(Cl)oc12

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ELANE P08246 8/20 0.41
PSMB8 P28062 1/20 0.40
PSMB5 P28074 1/20 0.40
FAAH O00519 1/20 0.38
MAOB P27338 2/20 0.37
MAOA P21397 1/20 0.37
ALDH1A1 P00352 2/20 0.36
MCL1 Q07820 1/20 0.36
CYP2A6 P11509 2/20 0.36
CYP1A2 P05177 1/20 0.36
CETP P11597 1/20 0.35

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
SCHEMBL5542790 0.79 ELANE (0.56) ELANEFAAHMAOBMAOAALDH1A1
SCHEMBL3954800 0.79 PSMB8 (0.59) ELANEPSMB8PSMB5MAOBMAOA
SCHEMBL9305490 0.76 ACHE (0.43) PSMB8PSMB5MAOBMAOAALDH1A1
SCHEMBL1121502 0.76 PSMB8 (0.40) ELANEPSMB8PSMB5MAOBMAOA
SCHEMBL288107 0.76 NUDT1 (0.56) ELANEFAAHMAOBMAOAALDH1A1
SCHEMBL1463176 0.76 GABRP (0.41) ELANEPSMB8PSMB5MAOBMAOA
SCHEMBL5542784 0.76 ELANE (0.41) ELANEFAAHMAOBMAOAALDH1A1
SCHEMBL6489417 0.76 ELANE (0.41) ELANEFAAHMAOBMAOAALDH1A1
SCHEMBL21780802 0.76 FAAH (0.41) ELANEFAAHMAOBMAOAALDH1A1
SCHEMBL1121801 0.76 NQO2 (0.46) ELANEMAOBMAOAALDH1A1CYP2A6

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4063368-B1 NITROGEN-CONTAINING COMPOUND AND ELECTRONIC ELEMENT COMPRISING SAME, AND ELECTRONIC APPARATUS SHAANXI LIGHTE OPTOELECTRONICS MAT CO LTD (CN) 2024-06-26 EP disclosed
US-20240025906-A1 KINASE MODULATORS AND METHODS OF USE THEREOF SUNDANCE BIOSCIENCES, INC. 2024-01-25 US disclosed
US-20240025906-A1 KINASE MODULATORS AND METHODS OF USE THEREOF SUNDANCE BIOSCIENCES, INC. 2024-01-25 US disclosed
US-20230008185-A1 NITROGEN-CONTAINING COMPOUND, ELECTRONIC COMPONENT AND ELECTRONIC DEVICE INCLUDING SAME SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-01-12 US disclosed
US-20220274968-A1 Oxazole And Oxadiazole Derivatives Useful As Agonists Of Free Fatty Acid Receptor 1 GBIOTECH S.À.R.L. (CH) 2022-09-01 US disclosed
US-8003675-B2 3,4-dihalogenoisothiazole derivative, and agricultural or horticultural plant disease-controlling agent KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2011-08-23 US disclosed
US-8003675-B2 3,4-dihalogenoisothiazole derivative, and agricultural or horticultural plant disease-controlling agent KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2011-08-23 US disclosed
WO-2010070822-A1 SAFENERS FOR HERBICIDES, HERBICIDAL COMPOSITIONS WITH REDUCED CHEMICAL DAMAGE AND SAFENING METHOD USING SAME クミアイ化学工業株式会社 (JP) 2010-06-24 WO disclosed
US-20090240057-A1 3,4-Dihalogenoisothiazole Derivative, and Agricultural or Horticultural Plant Disease-Controlling Agent KUMIAI CHEMICAL INDUSTRY CO., LTD. AND IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2009-09-24 US disclosed
US-20090240057-A1 3,4-Dihalogenoisothiazole Derivative, and Agricultural or Horticultural Plant Disease-Controlling Agent KUMIAI CHEMICAL INDUSTRY CO., LTD. AND IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2009-09-24 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 (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-20090240057-A1 3,4-Dihalogenoisothiazole Derivative, and Agricultural or Horticultural Plant Disease-Controlling Agent CBR3, HDHD5, OSR1 ELANE 4095/4885PSMB8 3615/4885PSMB5 890/4885
US-20230008185-A1 NITROGEN-CONTAINING COMPOUND, ELECTRONIC COMPONENT AND ELECTRONIC DEVICE INCLUDING SAME DNTT, EML4, NME1 ELANE 701/4885PSMB8 3851/4885PSMB5 3439/4885
US-20240025906-A1 KINASE MODULATORS AND METHODS OF USE THEREOF TYK2, JAK1, JAK3 ELANE 4593/4885PSMB8 3755/4885PSMB5 3130/4885
US-20220274968-A1 Oxazole And Oxadiazole Derivatives Useful As Agonists Of Free Fatty Acid Receptor 1 FFAR2, FFAR1, FFAR3 ELANE 4078/4885PSMB8 3068/4885PSMB5 3282/4885

“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.