SCHEMBL10197309

SCHEMBL10197309

CC(C)(C)CC(C)(C(=O)OCC1CO1)C(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.45
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
MGLL Q99685 2/20 0.33

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
SCHEMBL19988394 0.87 ALDH1A1 (0.42) ALDH1A1TP53CYP3A4TSHRMAPK1
SCHEMBL14377825 0.86 ALDH1A1 (0.41) ALDH1A1TP53CYP3A4TSHRMAPK1
SCHEMBL9953005 0.85 ALDH1A1 (0.46) ALDH1A1TP53CYP3A4TSHRMAPK1
SCHEMBL18923157 0.83 LMNA (0.50) ALDH1A1
SCHEMBL9951804 0.83 ALDH1A1 (0.47) ALDH1A1TP53CYP3A4TSHRMAPK1
SCHEMBL18923158 0.82 LMNA (0.46) ALDH1A1MGLL
SCHEMBL18676200 0.81 CA2 (0.43) ALDH1A1
SCHEMBL20001202 0.80 ALDH1A1 (0.45) ALDH1A1TP53CYP3A4TSHRMAPK1
SCHEMBL24094074 0.80 ALDH1A1 (0.41) ALDH1A1TP53CYP3A4TSHRMAPK1
SCHEMBL22562930 0.79 ALDH1A1 (0.30) ALDH1A1TP53CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230217718-A1 METHOD FOR PRODUCING LIGHT-EMITTING ELEMENTS CENTRAL GLASS COMPANY, LIMITED (JP) 2023-07-06 US disclosed
US-20230140810-A1 MATERIAL FOR FORMING ADHESIVE FILM, PATTERNING PROCESS, AND METHOD FOR FORMING ADHESIVE FILM SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-04 US disclosed
US-20220340528-A1 Photobase Generator, Compound, Photoreactive Composition, and Reaction Product TOKYO UNIVERSITY OF SCIENCE FOUNDATION (JP) 2022-10-27 US disclosed
US-20210253826-A1 Photoreactive Composition, Reaction Product, and Method of Producing Reaction Product TOKYO UNIVERSITY OF SCIENCE FOUNDATION (JP) 2021-08-19 US disclosed
US-8105760-B2 Patterning process and pattern surface coating composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-01-31 US disclosed
US-20090053657-A1 PATTERNING PROCESS AND PATTERN SURFACE COATING COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2009-02-26 US disclosed
WO-2009023544-A2 DOSAGE UNIT ANION-EXCHANGE POLYMER PHARMACEUTICAL COMPOSITIONS ILYPSA, INC. (US) 2009-02-19 WO 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-20220340528-A1 Photobase Generator, Compound, Photoreactive Composition, and Reaction Product GNB1, GNG2, PPOX ALDH1A1 3199/4885TP53 4325/4885CYP3A4 2106/4885
US-20210253826-A1 Photoreactive Composition, Reaction Product, and Method of Producing Reaction Product CYP1B1, CYBA, TYR ALDH1A1 975/4885TP53 2510/4885CYP3A4 84/4885

“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.