SCHEMBL1852272

SCHEMBL1852272

CC(C)CCOc1ccccc1C=O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.69
HTT P42858 2/20 0.69
HPGD P15428 1/20 0.69
SMN1; SMN2 Q16637 1/20 0.69
PTGDR2 Q9Y5Y4 1/20 0.53
MAPT P10636 1/20 0.48
KMT2A Q03164 3/20 0.46
LMNA P02545 2/20 0.46
GAA P10253 1/20 0.46
MEN1 O00255 2/20 0.46
IDO1 P14902 1/20 0.46
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
RAD52 P43351 1/20 0.45
ADRA2A P08913 1/20 0.44
ADRA2B P18089 1/20 0.44
ADRA2C P18825 1/20 0.44
TLR8 Q9NR97 1/20 0.44
MCHR1 Q99705 1/20 0.44

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
SCHEMBL29378504 0.91 ALDH1A1 (0.67) ALDH1A1HTTHPGDSMN1; SMN2PTGDR2
SCHEMBL637756 0.89 ALDH1A1 (0.59) ALDH1A1HTTHPGDSMN1; SMN2PTGDR2
SCHEMBL10573482 0.86 ALDH1A1 (0.65) ALDH1A1HTTHPGDSMN1; SMN2PTGDR2
SCHEMBL4808585 0.85 ALDH1A1 (0.62) ALDH1A1HTTHPGDSMN1; SMN2PTGDR2
SCHEMBL271619 0.84 ALDH1A1 (0.66) ALDH1A1HTTHPGDSMN1; SMN2PTGDR2
SCHEMBL28639293 0.83 ALDH1A1 (0.47) ALDH1A1HTTHPGDSMN1; SMN2PTGDR2
SCHEMBL21410036 0.83 ALDH1A1 (0.61) ALDH1A1HTTHPGDSMN1; SMN2PTGDR2
1,2-Diisopentoxybenzene SCHEMBL2843498 0.82 HTT (0.62) ALDH1A1HTTSMN1; SMN2MAPTLMNA
SCHEMBL6914412 0.82 ALDH1A1 (1.00) ALDH1A1HTTHPGDSMN1; SMN2PTGDR2
SCHEMBL5661861 0.82 ALDH1A1 (0.46) ALDH1A1HTTHPGDSMN1; SMN2PTGDR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117624047-B Antitumor compound Beijing Keyou Ai Technology Co.,Ltd. (CN) 2026-05-26 CN disclosed
US-20250326744-A1 PIPERAZINE DERIVATIVE OR SALT THEREOF, AND PHARMACEUTICAL COMPOSITION FUJIFILM CORPORATION (JP) 2025-10-23 US disclosed
CN-119816484-A Novel piperazine derivative or salt thereof and pharmaceutical composition 富士胶片株式会社 2025-04-11 CN disclosed
CN-117624047-A Antitumor compound 北京科佑爱科技有限责任公司 2024-03-01 CN disclosed
WO-2024043334-A1 NOVEL PIPERAZINE DERIVATIVE OR SALT THEREOF AND PHARMACEUTICAL COMPOSITION 富士フイルム株式会社 2024-02-29 WO disclosed
CN-113582988-A Pyridinocyclic compound and medical application thereof 正大天晴药业集团股份有限公司 2021-11-02 CN disclosed
EP-2097419-B1 BENZOFUROPYRIMIDINONES AS PROTEIN KINASE INHIBITORS EXELIXIS INC (US) 2011-05-25 EP disclosed
CN-101965351-A Benzofuran pyrimidinones EXELIXIS INC 2011-02-02 CN disclosed
US-20090247559-A1 Benzofuropyrimidinones EXELIXIS, INC. (US) 2009-10-01 US disclosed
EP-2097419-A1 BENZOFUROPYRIMIDINONES AS PROTEIN KINASE INHIBITORS Exelixis, Inc. (US) 2009-09-09 EP disclosed
WO-2009086264-A1 BENZOFUROPYRIMIDINONES AS PROTEIN KINASE INHIBITORS EXELIXIS, INC. (US) 2009-07-09 WO disclosed
CN-1040549-C Liquid hard surface detergent compositions containing zwitterionic and cationic detergent, surfactants and monoethanolamine and/or beta-aminoalkanol PROCTER & GAMBLE (US) 1998-11-04 CN disclosed
CN-1078745-A The liquid hard surface detergent compositions that contains tensio-active agent and alkanolamine PROCTER & GAMBLE (US) 1993-11-24 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-20090247559-A1 Benzofuropyrimidinones F12, BRI3BP, BRD1 ALDH1A1 315/4885HTT 1923/4885HPGD 2284/4885
US-20250326744-A1 PIPERAZINE DERIVATIVE OR SALT THEREOF, AND PHARMACEUTICAL COMPOSITION ABCB11, ABCC1, SLC11A2 ALDH1A1 774/4885HTT 1241/4885HPGD 1533/4885

“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.