SCHEMBL3379669

SCHEMBL3379669

C#Cc1ccc(N)c(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.50
CYP3A4 P08684 5/20 0.50
ALDH1A1 P00352 5/20 0.48
MAPK1 P28482 1/20 0.48
GAA P10253 2/20 0.42
CA12 O43570 3/20 0.41
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
CA9 Q16790 3/20 0.41
CA14 Q9ULX7 3/20 0.41
ALOX15 P16050 2/20 0.41
CA4 P22748 2/20 0.41
ESR2 Q92731 1/20 0.41
THRB P10828 1/20 0.41
HPGD P15428 1/20 0.41
CASP1 P29466 1/20 0.41
RECQL P46063 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 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
SCHEMBL4169804 0.78 NR4A1 (0.44) TSHRCYP3A4ALDH1A1CA12CA1
SCHEMBL31338515 0.78 NR4A1 (0.44) TSHRCYP3A4ALDH1A1CA12CA1
SCHEMBL2236921 0.78 AHR (0.43) TSHRCYP3A4ALDH1A1MAPK1HSD17B10
SCHEMBL77027 0.77 CYP3A4 (0.50) TSHRCYP3A4ALDH1A1MAPK1GAA
Hydrochloric Acid SCHEMBL18493517 0.76 NR4A1 (0.42) TSHRCYP3A4ALDH1A1CA12CA1
SCHEMBL689815 0.74 PTPN1 (0.41) CYP3A4ALDH1A1CA12CA1CA2
SCHEMBL9861993 0.74 TRPV4 (0.34) CA12CA1CA2CA9CA14
SCHEMBL25026499 0.74 CYP3A4 (0.46) TSHRCYP3A4ALDH1A1MAPK1GAA
SCHEMBL20929228 0.73 ALDH1A1 (0.50) TSHRCYP3A4ALDH1A1GAACA1
SCHEMBL2810033 0.73 CYP3A4 (0.50) TSHRCYP3A4ALDH1A1MAPK1CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113912551-B Recyclable aromatic amine reagent and preparation and application thereof 浙江新和成股份有限公司 2023-04-18 CN disclosed
EP-3481819-B1 COMPOUNDS AND THEIR USE FOR REDUCING URIC ACID LEVELS ACQUIST LLC (US) 2022-06-01 EP disclosed
EP-3481819-B1 COMPOUNDS AND THEIR USE FOR REDUCING URIC ACID LEVELS ACQUIST LLC (US) 2022-06-01 EP disclosed
CN-109476642-B Compounds and their use for reducing uric acid levels 阿奎斯特有限责任公司 2022-01-25 CN disclosed
US-20210236495-A1 Compounds and Their Use for Reducing Uric Acid Levels ACQUIST LLC (US) 2021-08-05 US disclosed
US-20210236495-A1 Compounds and Their Use for Reducing Uric Acid Levels ACQUIST LLC (US) 2021-08-05 US disclosed
US-11020397-B2 Compounds and their use for reducing uric acid levels ACQUIST LLC (US) 2021-06-01 US disclosed
US-11020397-B2 Compounds and their use for reducing uric acid levels ACQUIST LLC (US) 2021-06-01 US disclosed
US-20200268757-A1 Compounds and Their Use for Reducing Uric Acid Levels ACQUIST LLC (US) 2020-08-27 US disclosed
US-20200268757-A1 Compounds and Their Use for Reducing Uric Acid Levels ACQUIST LLC (US) 2020-08-27 US disclosed
US-20190117654-A1 Compounds and Their Use for Reducing Uric Acid Levels ACQUIST LLC (US) 2019-04-25 US disclosed
WO-2018009615-A9 COMPOUNDS AND THEIR USE FOR REDUCING URIC ACID LEVELS ACQUIST LLC (US) 2018-06-28 WO disclosed
WO-2018009615-A1 COMPOUNDS AND THEIR USE FOR REDUCING URIC ACID LEVELS ACQUIST LLC (US) 2018-01-11 WO disclosed
EP-1989186-B1 HYDANTOIN BASED KINASE INHIBITORS HOFFMANN LA ROCHE (CH) 2010-11-17 EP disclosed
US-7612212-B2 2-[(S)-2-((S)-2,5-dioxo-4-phenyl-imidazolidin-1-yl)-4-methyl-pentanoylamino]-thiazole-4-carboxylic acid methyl ester; mitogen activated protein/extracellular signal regulated kinase kinase inhibitor; anticarcinogenic agent, cognition activator, nervous and autoimmune system disorders HOFFMANN-LA ROCHE INC. (US) 2009-11-03 US disclosed
EP-1989186-A1 HYDANTOIN BASED KINASE INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2008-11-12 EP disclosed
WO-2008101840-A1 COMBINATION OF ERLOTINIB AND MEK-INHIBITORS FOR INHIBITING PROLIFERATION OF TUMOR CELLS F. HOFFMANN-LA ROCHE AG (CH) 2008-08-28 WO disclosed
US-20080207563-A1 METHOD FOR INHIBITING PROLIFERATION OF TUMOR CELLS NIU HUIFENG 2008-08-28 US disclosed
WO-2007096259-A1 HYDANTOIN BASED KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2007-08-30 WO disclosed
US-20070197617-A1 Substituted hydantoins CHEN SHAOQING 2007-08-23 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 (6 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-20070197617-A1 Substituted hydantoins HNMT, HRH3, BRAF TSHR 3695/4885CYP3A4 898/4885ALDH1A1 963/4885
US-20210236495-A1 Compounds and Their Use for Reducing Uric Acid Levels XDH, OAT, URB2 TSHR 2953/4885CYP3A4 770/4885ALDH1A1 226/4885
US-20200268757-A1 Compounds and Their Use for Reducing Uric Acid Levels XDH, OAT, URB2 TSHR 2953/4885CYP3A4 770/4885ALDH1A1 226/4885
US-11020397-B2 Compounds and their use for reducing uric acid levels XDH, OAT, UGT2B7 TSHR 2010/4885CYP3A4 240/4885ALDH1A1 95/4885
US-20080207563-A1 METHOD FOR INHIBITING PROLIFERATION OF TUMOR CELLS MKI67, BRAF, MYC TSHR 3069/4885CYP3A4 3835/4885ALDH1A1 2822/4885
US-20190117654-A1 Compounds and Their Use for Reducing Uric Acid Levels XDH, OAT, URB2 TSHR 2953/4885CYP3A4 770/4885ALDH1A1 226/4885

“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.