SCHEMBL3689366

SCHEMBL3689366

C#CCc1cccc(CO)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 2/20 0.45
PRSS1 P07477 1/20 0.42
PRSS2 P07478 1/20 0.42
PRSS3 P35030 1/20 0.42
TSHR P16473 1/20 0.42
PRKCI P41743 1/20 0.41
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
DAO P14920 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.38
NOS3 P29474 2/20 0.37
NOS1 P29475 2/20 0.37
NOS2 P35228 2/20 0.37
CFTR P13569 1/20 0.37
S1PR1 P21453 2/20 0.36
FFAR1 O14842 1/20 0.36
ACMSD Q8TDX5 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA7 P36544 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
SCHEMBL9350384 0.89 MEN1 (0.41) ENPP2TSHR
SCHEMBL138492 0.81 ACHE (0.42) TSHR
SCHEMBL123838 0.81 TSHR (0.61) ENPP2PRSS1PRSS2PRSS3TSHR
SCHEMBL13001900 0.78 ENPP2 (0.53) ENPP2FFAR1
SCHEMBL26920214 0.78 TSHR (0.42) ENPP2TSHR
SCHEMBL357440 0.78 ENPP2 (0.54) ENPP2
SCHEMBL4374157 0.78 ENPP2 (0.58) ENPP2PRSS1PRSS2PRSS3TSHR
Hydrochloric Acid SCHEMBL14334287 0.78 ENPP2 (0.58) ENPP2PRSS1PRSS2PRSS3TSHR
SCHEMBL10546841 0.77 CALM1 (0.50) PRSS1PRSS2PRSS3TSHRACMSD
SCHEMBL3694910 0.77 TSHR (0.43) PRSS1PRSS2PRSS3TSHRCYP11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0584223-B1 NOVEL IMMUNOSUPPRESSIVE COMPOUNDS VERTEX PHARMA (US) 1999-08-11 EP claimed
EP-0789512-B1 MIXTURES AND AGENTS SUITABLE FOR COMBATTING HYLOTRUPES BAJULUS AND PYRRHIDIUM SANGUINEUM BASF AG (DE) 1999-01-07 EP claimed
US-20250339406-A1 NSD FAMILY INHIBITORS AND METHODS OF TREATMENT THEREWITH THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2025-11-06 US disclosed
US-12364688-B2 NSD family inhibitors and methods of treatment therewith THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2025-07-22 US disclosed
US-20230046569-A1 NSD FAMILY INHIBITORS AND METHODS OF TREATMENT THEREWITH THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2023-02-16 US disclosed
US-20230046569-A1 NSD FAMILY INHIBITORS AND METHODS OF TREATMENT THEREWITH THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2023-02-16 US disclosed
US-11324729-B2 NSD family inhibitors and methods of treatment therewith THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2022-05-10 US disclosed
US-11324729-B2 NSD family inhibitors and methods of treatment therewith THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2022-05-10 US disclosed
CN-112040947-A NSD family inhibitors and methods of treatment therewith 密歇根大学董事会 2020-12-04 CN disclosed
EP-3720439-A1 NSD FAMILY INHIBITORS AND METHODS OF TREATMENT THEREWITH The Regents Of The University Of Michigan (US) 2020-10-14 EP disclosed
US-20190183865-A1 NSD FAMILY INHIBITORS AND METHODS OF TREATMENT THEREWITH THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2019-06-20 US disclosed
EP-1203760-B1 Method for producing cyclopropanecarboxylates SUMITOMO CHEMICAL CO (JP) 2005-04-13 EP disclosed
US-6706910-B2 BY TRANSESTERIFICATION OF A CYCLOPROPANECARBOXYLATE AND A MONOHYDROXY COMPOUND IN THE PRESENCE OF A LITHIUM ALKOXIDE OR LITHIUM ARYLOXIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-03-16 US disclosed
US-6531626-B1 Transesterification in the presence of a samarium alkoxide SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-03-11 US disclosed
EP-0992479-B1 Method for producing cyclopropanecarboxylates SUMITOMO CHEMICAL CO (JP) 2003-01-02 EP disclosed
US-6441220-B1 ESTERIFICATION WITH ALCOHOL IN PRESENCE OF BASIC CATALYSTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-08-27 US disclosed
EP-1203760-A1 Method for producing cyclopropanecarboxylates SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-05-08 EP disclosed
US-20020052525-A1 Method for producing cyclopropanecarboxylates SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-05-02 US disclosed
EP-1061065-A2 Methods for producing cyclopropane carboxylates SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-12-20 EP disclosed
EP-0992479-A1 Method for producing cyclopropanecarboxylates SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-04-12 EP 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-12364688-B2 NSD family inhibitors and methods of treatment therewith NSD3, NSD2, NSD1 ENPP2 2510/4885PRSS1 109/4885PRSS2 855/4885
US-20230046569-A1 NSD FAMILY INHIBITORS AND METHODS OF TREATMENT THEREWITH NSD3, NSD2, NSD1 ENPP2 2510/4885PRSS1 109/4885PRSS2 855/4885
US-20020052525-A1 Method for producing cyclopropanecarboxylates CYP8B1, SRD5A2, CYP21A2 ENPP2 3485/4885PRSS1 4608/4885PRSS2 4336/4885
US-20250339406-A1 NSD FAMILY INHIBITORS AND METHODS OF TREATMENT THEREWITH NSD3, NSD2, NSD1 ENPP2 2510/4885PRSS1 109/4885PRSS2 855/4885
US-11324729-B2 NSD family inhibitors and methods of treatment therewith NSD3, NSD2, NSD1 ENPP2 2510/4885PRSS1 109/4885PRSS2 855/4885
US-20190183865-A1 NSD FAMILY INHIBITORS AND METHODS OF TREATMENT THEREWITH NSD3, NSD2, NSD1 ENPP2 2510/4885PRSS1 109/4885PRSS2 855/4885

“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.