SCHEMBL20109322

SCHEMBL20109322

C=C=CC(=O)OCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 4/20 0.59
LMNA P02545 3/20 0.56
ALDH1A1 P00352 5/20 0.52
AKR1B10 O60218 2/20 0.51
AKR1B1 P15121 2/20 0.51
CA12 O43570 2/20 0.51
CA9 Q16790 2/20 0.51
CA4 P22748 1/20 0.51
CA6 P23280 1/20 0.51
CA5A P35218 1/20 0.51
CA7 P43166 1/20 0.51
CA14 Q9ULX7 1/20 0.51
CA5B Q9Y2D0 1/20 0.51
TDP1 Q9NUW8 2/20 0.50
MAPK1 P28482 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
SLC6A2 P23975 1/20 0.50
SLC6A3 Q01959 1/20 0.50
KMT2A Q03164 1/20 0.50
TTR P02766 1/20 0.47

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
SCHEMBL14952780 0.84 HCAR2 (0.61) HCAR2LMNAALDH1A1AKR1B10AKR1B1
SCHEMBL34054 0.79 HCAR2 (0.65) HCAR2LMNAALDH1A1AKR1B10AKR1B1
SCHEMBL812094 0.79 HCAR2 (0.65) HCAR2LMNAALDH1A1AKR1B10AKR1B1
SCHEMBL28230354 0.79 HCAR2 (0.65) HCAR2LMNAALDH1A1AKR1B10AKR1B1
Benzene SCHEMBL28307095 0.79 HCAR2 (0.65) HCAR2LMNAALDH1A1AKR1B10AKR1B1
SCHEMBL6451169 0.79 HCAR2 (0.56) HCAR2LMNAALDH1A1AKR1B10AKR1B1
SCHEMBL337504 0.79 HCAR2 (0.89) HCAR2LMNAALDH1A1AKR1B10AKR1B1
SCHEMBL337503 0.79 HCAR2 (0.89) HCAR2LMNAALDH1A1AKR1B10AKR1B1
SCHEMBL9395526 0.79 HCAR2 (0.69) HCAR2LMNAALDH1A1AKR1B10AKR1B1
SCHEMBL357565 0.79 HCAR2 (0.89) HCAR2LMNAALDH1A1AKR1B10AKR1B1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024198014-A1 CONCRETE MODIFYING AGENT AND PREPARATION METHOD THEREFOR, CONCRETE ADMIXTURE AND CONCRETE COMPOSITION 石家庄市长安育才建材有限公司 2024-10-03 WO claimed
WO-2024198014-A1 CONCRETE MODIFYING AGENT AND PREPARATION METHOD THEREFOR, CONCRETE ADMIXTURE AND CONCRETE COMPOSITION 石家庄市长安育才建材有限公司 2024-10-03 WO disclosed
US-20230174506-A1 (DI)AMINATION OF ACTIVATED ALLENE COMPOUNDS, DERIVATIVES THEREOF, AND METHODS FOR SYNTHESIS OF THE SAME PURDUE RESEARCH FOUNDATION 2023-06-08 US disclosed
CN-113874079-A Bridged tricyclic carbamoylpyridone compounds and pharmaceutical use thereof 吉利德科学公司 2021-12-31 CN disclosed
CN-110408235-A A kind of dye composite and application thereof HANGZHOU YIKANG NEW MAT CO LTD 2019-11-05 CN disclosed
US-20180118770-A1 N-Heterocyclic Phosphines THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, LAS VEGAS 2018-05-03 US disclosed
CN-1146587-C Compositions having ethylenic backbone and benzylic, allylic, or ether-containing side-chains, oxygen scavenging compositions containing the same, and polymer �з��ﰺ��ѧ��˾ 2004-04-21 CN disclosed
CN-1187206-A Compositions having ethylenic backbone and benzylic, allylic, or ether-containing side-chains, oxygen scavenging compositions containing the same, and polymer CHEVRON CHEM CO (US) 1998-07-08 CN 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-20180118770-A1 N-Heterocyclic Phosphines NANP, PPIP5K2, PHPT1 HCAR2 2793/4885LMNA 3601/4885ALDH1A1 4621/4885
US-20230174506-A1 (DI)AMINATION OF ACTIVATED ALLENE COMPOUNDS, DERIVATIVES THEREOF, AND METHODS FOR SYNTHESIS OF THE SAME NAAA, PAM, AANAT HCAR2 1404/4885LMNA 1994/4885ALDH1A1 583/4885

“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.