SCHEMBL1748171

SCHEMBL1748171

CSc1nc2cc(Cl)ccc2s1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 1.00
NPSR1 Q6W5P4 1/20 1.00
PPARA Q07869 7/20 0.58
ALOX5 P09917 3/20 0.52
LOXL2 Q9Y4K0 1/20 0.51
KEAP1 Q14145 1/20 0.51
IDO1 P14902 1/20 0.51
TMEM97 Q5BJF2 2/20 0.49

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
SCHEMBL30602946 1.00 SMN1; SMN2 (1.00) SMN1; SMN2NPSR1PPARAALOX5LOXL2
SCHEMBL9153184 0.91 SMN1; SMN2 (0.82) SMN1; SMN2NPSR1PPARAALOX5LOXL2
SCHEMBL6662857 0.86 SMN1; SMN2 (0.75) SMN1; SMN2NPSR1PPARAKEAP1
SCHEMBL8523609 0.85 SMN1; SMN2 (0.74) SMN1; SMN2NPSR1PPARAALOX5LOXL2
SCHEMBL30423143 0.83 SMN1; SMN2 (0.71) SMN1; SMN2NPSR1PPARAALOX5TMEM97
SCHEMBL9622398 0.83 SMN1; SMN2 (0.71) SMN1; SMN2NPSR1PPARAALOX5TMEM97
SCHEMBL4051451 0.80 SMN1; SMN2 (0.64) SMN1; SMN2NPSR1PPARAALOX5
SCHEMBL4051455 0.79 SMN1; SMN2 (0.62) SMN1; SMN2NPSR1PPARAALOX5
SCHEMBL4051453 0.79 SMN1; SMN2 (0.62) SMN1; SMN2NPSR1PPARAALOX5
SCHEMBL14327114 0.79 SMN1; SMN2 (0.65) SMN1; SMN2NPSR1PPARAKEAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-59053475-A None JP disclosed
JP-56140986-A None JP disclosed
CN-111454281-B Merocyanine compound, dye for biomolecule labeling, kit and contrast agent composition containing same SFC株式会社 2024-04-09 CN disclosed
CN-116926578-A Method for synthesizing heteroaryl thiophenol 新疆大学 2023-10-24 CN disclosed
CN-111454281-A Merocyanine compound, dye for biomolecule labeling comprising same, kit, and contrast agent composition SFC株式会社 2020-07-28 CN disclosed
CN-107304219-B Merocyanine compound, dye for biomolecule labeling comprising same, kit, and contrast agent composition SFC株式会社 2020-05-15 CN disclosed
EP-2822945-B1 AMINOMETHYLENE PYRAZOLONES WITH THERAPEUTIC ACTIVITY COMPOUND HANDLING B V (NL) 2019-06-19 EP disclosed
US-10071987-B2 Aminomethylene pyrazolones with therapeutic activity COMPOUND HANDLING B.V. (NL) 2018-09-11 US disclosed
US-10029996-B2 Class of cyano-substituted asymmetric cyanine dyes, synthesizing method and application thereof DALIAN UNIVERSITY OF TECHNOLOGY (CN) 2018-07-24 US disclosed
US-9969887-B2 Merocyanine-based compounds, and dyes, kits and contrast medium compositions for labelling biomolecules comprising the same SFC CO., LTD. (KR) 2018-05-15 US disclosed
EP-0467155-B1 Blue spectral sensitizers for non-tabular silver halide elements DU PONT (US) 1995-02-22 EP disclosed
US-5108887-A Zeromethine merocyanine dyes as J-aggregating spectral sensitizers for tabular emulsions E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-04-28 US disclosed
US-5102781-A Used for radiographic elements designed for exposure to intensifying screens E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-04-07 US disclosed
EP-0467155-A1 Blue spectral sensitizers for non-tabular silver halide elements E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-01-22 EP disclosed
US-5053408-A Cardiovascular disorders KYOWA HAKKO KOGYO CO., LTD. (JP) 1991-10-01 US disclosed
EP-0393574-A2 Hexitol derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1990-10-24 EP disclosed
JP-S5953475-A PREPARATION OF BENZOTHIAZOLONE DERIVATIVE FUJISAWA PHARMACEUT CO LTD 1984-03-28 JP disclosed
EP-0055428-B1 BIS-(3-SULFOPROPYL)ETHERS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ALKYLATING AGENTS FOR ORGANIC BASES Agfa-Gevaert AG (DE) 1984-03-14 EP disclosed
EP-0055428-A1 Bis-(3-sulfopropyl)ethers, process for their preparation and their use as alkylating agents for organic bases Agfa-Gevaert AG (DE) 1982-07-07 EP disclosed
JP-S56140986-A PRODUCTION OF 5-CHLORO-3- 4- 2-HYDROXYETHYL -1-PIPERAZINYL - CARBOMETHYL-2-BENZOTHIAZOLINE OR ITS SALT AND INTERMEDIATE HAMARI YAKUHIN KOGYO KK 1981-11-04 JP 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 (2 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-10029996-B2 Class of cyano-substituted asymmetric cyanine dyes, synthesizing method and application thereof HCCS, MKI67, MB SMN1; SMN2 1982/4885NPSR1 4262/4885PPARA 4348/4885
US-10071987-B2 Aminomethylene pyrazolones with therapeutic activity H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, NCOA3, CBR3 SMN1; SMN2 2217/4885NPSR1 2175/4885PPARA 1915/4885

“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.