SCHEMBL577853

SCHEMBL577853

C#Cc1cccc(C=O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
CA12 O43570 2/20 0.46
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA9 Q16790 2/20 0.46
CA14 Q9ULX7 1/20 0.46
FFAR1 O14842 2/20 0.44
UNG P13051 1/20 0.44
CYP2A6 P11509 1/20 0.42
PTPN1 P18031 1/20 0.40
SRC P12931 1/20 0.39
TRIM24 O15164 1/20 0.38
TRIM33 Q9UPN9 1/20 0.38
CYP1A1 P04798 1/20 0.38
CYP1B1 Q16678 1/20 0.38
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
FBP1 P09467 1/20 0.36
KDM4E B2RXH2 1/20 0.35
PTGS2 P35354 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
SCHEMBL29569326 1.00 ALDH1A1 (0.48) ALDH1A1CA12CA1CA2CA9
SCHEMBL10633500 0.82 FFAR1 (0.58) ALDH1A1CA12CA1CA2CA9
SCHEMBL29144796 0.80 CDK4 (0.55) ALDH1A1CA12CA1CA2CA9
SCHEMBL29144797 0.80 CDK4 (0.55) ALDH1A1CA12CA1CA2CA9
Phenylacetylene SCHEMBL6530256 0.80 ALDH1A1 (0.64) ALDH1A1FFAR1UNGCYP2A6
SCHEMBL3109157 0.80 ALDH1A1 (0.50) ALDH1A1CA12CA1CA2CA9
SCHEMBL23158521 0.78 CA12 (0.41) ALDH1A1CA12CA1CA2CA9
SCHEMBL2497552 0.78 TDP1 (0.48) ALDH1A1CA12CA1CA2CA9
SCHEMBL16953580 0.78 CA12 (0.41) CA12CA1CA2CA9CA14
SCHEMBL67236 0.78 FBP1 (0.56) ALDH1A1FFAR1UNGMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250326787-A1 MANUFACTURING OPTIMIZATION OF GL-2045, A MULTIMERIZING STRADOMER GLIKNIK INC (US) 2025-10-23 US claimed
CN-119318887-A Graphite alkyne multilayer composite membrane and preparation method thereof 北京化工大学 2025-01-17 CN claimed
CN-115869785-B Ultrafast preparation method of graphite alkyne composite membrane 北京化工大学 2024-11-26 CN claimed
CN-115869785-A Ultrafast preparation method of graphite alkyne composite membrane 北京化工大学 2023-03-31 CN claimed
CN-114437350-B Polyimide resin and preparation method and application thereof 波米科技有限公司 2022-09-16 CN claimed
CN-114437350-A Polyimide resin and preparation method and application thereof 波米科技有限公司 2022-05-06 CN claimed
CN-114315686-A Alkynyl-containing diamine, preparation method thereof and application thereof in preparation of photosensitive resin composition 波米科技有限公司 2022-04-12 CN claimed
EP-0411549-A1 1,4-dihydropyridine derivative, process for preparing the same and pharmaceutical composition containing the same Kaken Pharmaceutical Co., Ltd. (JP) 1991-02-06 EP claimed
EP-0050428-A1 Ethynylated aromatic compounds and process for making same Hughes Aircraft Company (US) 1982-04-28 EP claimed
JP-63256623-A None JP disclosed
US-20260144674-A1 Apparatus and Methods for Drug Delivery Using Microneedles CLEARSIDE BIOMEDICAL, INC. (US) 2026-05-28 US disclosed
US-20260138947-A1 BENZYLTRYPTAMINE COMPOUNDS REUNION NEUROSCIENCE INC (US) 2026-05-21 US disclosed
US-12624044-B2 SMARCA degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2026-05-12 US disclosed
US-12572075-B2 Composition, method of forming resist underlayer film, and method of forming resist pattern JSR CORPORATION (JP) 2026-03-10 US disclosed
JP-S63256623-A DIHYDROPYRIDINE RING-CONTAINING POLYMER AND ITS PRODUCTION AND USE HITACHI LTD 1988-10-24 JP disclosed
US-4766251-A Process for the preparation of ethynylbenzaldehydes NATIONAL STARCH AND CHEMICAL CORPORATION (US) 1988-08-23 US disclosed
US-4730032-A MOLDING MATERIALS NATIONAL STARCH AND CHEMICAL CORPORATION (US) 1988-03-08 US disclosed
EP-0257309-A2 Process for the preparation of ethynylbenzaldehydes National Starch and Chemical Investment Holding Corporation (US) 1988-03-02 EP disclosed
US-4465833-A ALKYNYLATION HALOGENATED BENZENE COMPOUND IN PRESENCE OF METAL CATALYST HUGHES AIRCRAFT COMPANY (US) 1984-08-14 US disclosed
EP-0050428-A1 Ethynylated aromatic compounds and process for making same Hughes Aircraft Company (US) 1982-04-28 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 (4 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-20260144674-A1 Apparatus and Methods for Drug Delivery Using Microneedles PROKR2, SLC10A2, GLP1R ALDH1A1 4190/4885CA12 1763/4885CA1 3424/4885
US-12572075-B2 Composition, method of forming resist underlayer film, and method of forming resist pattern TOP1, NAF1, ASH2L ALDH1A1 2358/4885CA12 2060/4885CA1 1324/4885
US-12624044-B2 SMARCA degraders and uses thereof SMARCA1, SMARCC1, SMARCA2 ALDH1A1 3543/4885CA12 3603/4885CA1 2045/4885
US-20260138947-A1 BENZYLTRYPTAMINE COMPOUNDS HTR2C, CNR2, HTR3B ALDH1A1 2693/4885CA12 2579/4885CA1 2642/4885

“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.