SCHEMBL2636129

SCHEMBL2636129

O=C(O)C#Cc1ccc(Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
ALOX15 P16050 1/20 0.44
FFAR1 O14842 4/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.42
GABRP O00591 1/20 0.41
GABRD O14764 1/20 0.41
GABRA1 P14867 1/20 0.41
GABRB1 P18505 1/20 0.41
GABRG2 P18507 1/20 0.41
GABRB3 P28472 1/20 0.41
GABRA5 P31644 1/20 0.41
GABRA3 P34903 1/20 0.41
GABRA2 P47869 1/20 0.41
GABRB2 P47870 1/20 0.41
GABRA4 P48169 1/20 0.41
GABRE P78334 1/20 0.41
GABRA6 Q16445 1/20 0.41
GABRG1 Q8N1C3 1/20 0.41
GABRG3 Q99928 1/20 0.41
GABRQ Q9UN88 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
SCHEMBL10794117 0.98 TSHR (0.43) TSHRALOX15FFAR1PTGDR2GABRP
SCHEMBL3858463 0.94 FFAR1 (0.44) TSHRALOX15FFAR1PTGDR2GABRP
Guanidine SCHEMBL2281423 0.90 LMNA (0.39) TSHRALOX15FFAR1PTGDR2GABRP
SCHEMBL9629232 0.88 FFAR1 (0.50) FFAR1GABRPGABRDGABRA1GABRB1
SCHEMBL8443823 0.82 KCNH2 (0.42) TSHRALOX15PTGDR2CES2CES1
SCHEMBL4487823 0.80 ACACB (0.46) TSHRALOX15FFAR1PTGDR2CES2
SCHEMBL6774688 0.80 NPC1 (0.42) TSHRALOX15PTGDR2CES2CES1
SCHEMBL11808810 0.79 PTGDR2 (0.36) TSHRFFAR1PTGDR2GABRPGABRD
SCHEMBL11808795 0.79 S100A4 (0.42) TSHRFFAR1PTGDR2SRD5A2
SCHEMBL6653836 0.79 APP (0.53) FFAR1GABRPGABRDGABRA1GABRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113548965-B Preparation method of 1,4 eneyne compound 南京工业大学 2022-07-26 CN claimed
CN-113548965-A Preparation method of 1, 4-eneyne compound 南京工业大学 2021-10-26 CN claimed
EP-1153024-B1 2-AMINO-6-ANILINO-PURINES AND THEIR USE AS MEDICAMENTS NOVARTIS AG (CH) 2004-04-28 EP claimed
JP-2002537300-A 2002-11-05 JP claimed
US-20020016329-A1 2-Amino-6-anilino-purines and their use as medicaments NOVARTIS AG (CH) 2002-02-07 US claimed
EP-1153024-A1 2-AMINO-6-ANILINO-PURINES AND THEIR USE AS MEDICAMENTS Novartis AG (CH) 2001-11-14 EP claimed
WO-2000049018-A1 2-AMINO-6-ANILINO-PURINES AND THEIR USE AS MEDICAMENTS NOVARTIS AG (CH) 2000-08-24 WO claimed
CN-122059959-A Synthesis method and application of pyrrolo [2,1-a ] isoquinoline compound 河南工业大学 2026-05-19 CN disclosed
US-12404265-B2 Substituted pyridine derivatives as SARM1 inhibitors NURA BIO, INC. (US) 2025-09-02 US disclosed
US-20240166662-A1 THIOPHENE BASED COMPOUNDS AND USE THEREOF AS BCKDK INHIBITORS Ramino-Bio Ltd. (IL) 2024-05-23 US disclosed
US-11970481-B1 Substituted pyridine derivatives as SARM1 inhibitors NURA BIO, INC. (US) 2024-04-30 US disclosed
US-20240116901-A1 SUBSTITUTED PYRIDINE DERIVATIVES AS SARM1 INHIBITORS NURA BIO, INC. 2024-04-11 US disclosed
EP-3953360-B1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF MONOACYLGLYCEROL LIPASE (MAGL) HOFFMANN LA ROCHE (CH) 2024-02-28 EP disclosed
EP-0663401-A1 MORPHINAN DERIVATIVE AND MEDICINAL USE TORAY INDUSTRIES, INC. (JP) 1995-07-19 EP disclosed
EP-0123908-B1 HEAT-DEVELOPABLE COLOR LIGHT-SENSITIVE MATERIAL FUJI PHOTO FILM CO., LTD. (JP) 1987-10-14 EP disclosed
EP-0123937-B1 A BASE PRECURSOR FOR HEAT-DEVELOPABLE PHOTOSENSITIVE MATERIAL FUJI PHOTO FILM CO., LTD. (JP) 1987-06-10 EP disclosed
US-4560763-A ALKYNYL CARBOXYLIC ACID SALT OF ORGANIC BASE FUJI PHOTO FILM CO., LTD. (JP) 1985-12-24 US disclosed
US-4499172-A Heat-developable color light-sensitive material with alkyl carboxylic acid base precursor containing triple bond FUJI PHOTO FILM CO., LTD. (JP) 1985-02-12 US disclosed
EP-0123908-A2 Heat-developable color light-sensitive material FUJI PHOTO FILM CO., LTD. (JP) 1984-11-07 EP disclosed
EP-0123937-A1 A base precursor for heat-developable photosensitive material FUJI PHOTO FILM CO., LTD. (JP) 1984-11-07 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 (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-12404265-B2 Substituted pyridine derivatives as SARM1 inhibitors SARM1, SARNP, ADRM1 TSHR 4223/4885ALOX15 4299/4885FFAR1 4246/4885
US-20020016329-A1 2-Amino-6-anilino-purines and their use as medicaments CDK14, CDK1, CCNB1 TSHR 4550/4885ALOX15 3352/4885FFAR1 4790/4885
US-11970481-B1 Substituted pyridine derivatives as SARM1 inhibitors SARM1, SARNP, ADRM1 TSHR 4223/4885ALOX15 4299/4885FFAR1 4246/4885
US-20240116901-A1 SUBSTITUTED PYRIDINE DERIVATIVES AS SARM1 INHIBITORS SARM1, SARNP, ADRM1 TSHR 4223/4885ALOX15 4299/4885FFAR1 4246/4885
US-20240166662-A1 THIOPHENE BASED COMPOUNDS AND USE THEREOF AS BCKDK INHIBITORS BCKDK, BCAT2, BCAT1 TSHR 3563/4885ALOX15 3385/4885FFAR1 3018/4885

“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.