SCHEMBL1649827

SCHEMBL1649827

CS(=O)(=O)Nc1cc2ccccc2o1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 3/20 0.47
▸ CCR2 P41597 1/20 0.44
▸ CA1 P00915 2/20 0.44
▸ CA9 Q16790 2/20 0.44
▸ CA12 O43570 1/20 0.44
▸ KEAP1 Q14145 2/20 0.43
▸ MAPK14 Q16539 1/20 0.42
▸ FLT3 P36888 1/20 0.42
▸ CYP2A6 P11509 1/20 0.42
▸ ALDH1A1 P00352 4/20 0.41
▸ MAOA P21397 3/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ MAOB P27338 2/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.41
▸ TAS1R3 Q7RTX0 1/20 0.41
▸ TAS1R1 Q7RTX1 1/20 0.41
▸ HPGD P15428 3/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ TYR P14679 1/20 0.41

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
SCHEMBL9486052 0.85 ALDH1A1 (0.49) CA2CA1CA9CA12ALDH1A1
SCHEMBL18493829 0.79 BCAT1 (0.54) CA2CA1CA9CA12KEAP1
SCHEMBL8764610 0.78 CCR2 (0.44) CA2CCR2CA1CA9CA12
SCHEMBL1419067 0.77 KDM4E (0.45) CA2CA9CA12FLT3CYP2A6
SCHEMBL1081207 0.76 HDAC3 (0.43) MAOAKDM4EMAOBTAS1R3TAS1R1
SCHEMBL28643561 0.74 CYP2A6 (0.47) CA2CA1CA9CA12FLT3
SCHEMBL10823736 0.73 NPC1 (0.54) CA1CA9CA12FLT3ALDH1A1
SCHEMBL16985241 0.72 CA2 (0.67) CA2CCR2CA1CA9CA12
SCHEMBL8764646 0.72 CYP2D6 (0.51) FLT3CYP2A6ALDH1A1MAOAKDM4E
SCHEMBL28279168 0.72 KMT2A (0.49) ALDH1A1KDM4ERXFP1HPGDSMN1; 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 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10562912-B2 Heterocyclic derivatives and use thereof C&C RESEARCH LABORATORIES (KR) 2020-02-18 — — US disclosed
CN-105753822-B A kind of benzofuran derivative, its preparation method and application 华润赛科药业有限责任公司 2018-04-03 — — CN disclosed
US-9334254-B2 Process for preparing sulfonamidobenzofuran derivatives SANOFI (FR) 2016-05-10 — — US disclosed
US-20160108056-A1 HETEROCYCLIC DERIVATIVES AND USE THEREOF C&C RESEARCH LABORATORIES (KR) 2016-04-21 — — US disclosed
CN-102933568-A Procede de preparation de derives de sulfonamido-benzofurane SANOFI AVENTIS 2013-02-13 — — CN disclosed
EP-2552900-A1 PROCESS FOR PREPARING AMINOBENZOFURAN DERIVATIVES SANOFI (FR) 2013-02-06 — — EP disclosed
EP-2552899-A1 PROCESS FOR PREPARING SULFONAMIDO-BENZOFURAN DERIVATIVES SANOFI (FR) 2013-02-06 — — EP disclosed
CN-102906081-A Process for preparing aminobenzofuran derivatives SANOFI AVENTIS 2013-01-30 — — CN disclosed
US-20130023677-A1 PROCESS FOR PREPARING AMINOBENZOFURAN DERIVATIVES SANOFI (FR) 2013-01-24 — — US disclosed
US-20130023678-A1 PROCESS FOR PREPARING SULFONAMIDOBENZOFURAN DERIVATIVES SANOFI (FR) 2013-01-24 — — US disclosed
CN-1479735-A Methanesulphonamido-benzofuran derivative, preparation method and use thereof as synthesis ntermediate ʥŵ��-�ϳ�ʵ���ҹ�˾ 2004-03-03 — — CN disclosed
US-20040010032-A1 2-butyl-3-(4-[3(dibutylamino)propoxy]benzoyl)-5-nitro-benzofuran hydrochloride and preparation thereof SANOFI (FR) 2004-01-15 — — US disclosed
EP-1351907-A1 2-BUTYL-3-(4- 3(DIBUTYLAMINO)PROPOXY BENZOYL)-5-NITRO-BENZOFURAN HYDROCHLORIDE AND PREPARATION THEREOF Sanofi-Aventis (FR) 2003-10-15 — — EP disclosed
EP-1343473-A1 PHARMACEUTICAL DRONEDARONE COMPOSITION FOR PARENTERAL ADMINISTRATION Sanofi-Aventis (FR) 2003-09-17 — — EP disclosed
EP-1343777-A1 METHANESULPHONAMIDO-BENZOFURAN, PREPARATION METHOD AND USE THEREOF AS SYNTHESIS INTERMEDIATE SANOFI-SYNTHELABO (FR) 2003-09-17 — — EP disclosed
WO-2002048078-A1 2-BUTYL-3-(4-[3(DIBUTYLAMINO)PROPOXY]BENZOYL)-5-NITRO-BENZOFURAN HYDROCHLORIDE AND PREPARATION THEREOF SANOFI-SYNTHELABO (FR) 2002-06-20 — — WO disclosed
WO-2002047660-A1 PHARMACEUTICAL DRONEDARONE COMPOSITION FOR PARENTERAL ADMINISTRATION SANOFI-SYNTHELABO (FR) 2002-06-20 — — WO disclosed
WO-2002048132-A1 METHANESULPHONAMIDO-BENZOFURAN, PREPARATION METHOD AND USE THEREOF AS SYNTHESIS INTERMEDIATE SANOFI-SYNTHELABO (FR) 2002-06-20 — — WO disclosed
EP-0775129-A1 3-BENZOYL BENZOFURAN DERIVATIVES AS THYROID HORMONE ANTAGONISTS KARO BIO AB (SE) 1997-05-28 — — EP disclosed
WO-1996005190-A1 3-BENZOYL BENZOFURAN DERIVATIVES AS THYROID HORMONE ANTAGONISTS KARO BIO AB (SE) 1996-02-22 — — WO 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 (5 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-20130023677-A1 PROCESS FOR PREPARING AMINOBENZOFURAN DERIVATIVES CYP2F1, F5, F12 CA2 2008/4885CCR2 4707/4885CA1 2475/4885
US-20160108056-A1 HETEROCYCLIC DERIVATIVES AND USE THEREOF STAT3, JAK2, STAT5A CA2 1985/4885CCR2 860/4885CA1 3407/4885
US-20130023678-A1 PROCESS FOR PREPARING SULFONAMIDOBENZOFURAN DERIVATIVES CYP2F1, STS, SULT1E1 CA2 1179/4885CCR2 294/4885CA1 1532/4885
US-10562912-B2 Heterocyclic derivatives and use thereof STAT3, JAK2, STAT5A CA2 1985/4885CCR2 860/4885CA1 3407/4885
US-20040010032-A1 2-butyl-3-(4-[3(dibutylamino)propoxy]benzoyl)-5-nitro-benzofuran hydrochloride and preparation thereof CYP2D6, DBF4, DUT CA2 3952/4885CCR2 4592/4885CA1 4827/4885

“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.

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