SCHEMBL31469169

SCHEMBL31469169

CCCCC/C=C\C/C=C\CCCC/C=C\CCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.85
NR5A2 O00482 2/20 0.82
NR5A1 Q13285 2/20 0.82
SMN1; SMN2 Q16637 1/20 0.82
MAPT P10636 1/20 0.73
RECQL P46063 1/20 0.65
FABP3 P05413 1/20 0.65
SELP P16109 1/20 0.61
S1PR1 P21453 1/20 0.56
ADRA1D P25100 1/20 0.56
PTAFR P25105 1/20 0.56
HTR1D P28221 1/20 0.56
HTR2C P28335 1/20 0.56
ADRA1B P35368 1/20 0.56
DRD3 P35462 1/20 0.56
TMEM97 Q5BJF2 1/20 0.56
PRKCE Q02156 1/20 0.54
PRKCQ Q04759 1/20 0.54
PRKCD Q05655 1/20 0.54
PRKCA P17252 1/20 0.54

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
SCHEMBL31615945 1.00 ALDH1A1 (0.85) ALDH1A1NR5A2NR5A1SMN1; SMN2MAPT
SCHEMBL31515814 1.00 ALDH1A1 (0.85) ALDH1A1NR5A2NR5A1SMN1; SMN2MAPT
SCHEMBL31366836 1.00 ALDH1A1 (0.85) ALDH1A1NR5A2NR5A1SMN1; SMN2MAPT
SCHEMBL31381149 1.00 ALDH1A1 (0.85) ALDH1A1NR5A2NR5A1SMN1; SMN2MAPT
SCHEMBL19651935 1.00 ALDH1A1 (0.85) ALDH1A1NR5A2NR5A1SMN1; SMN2MAPT
SCHEMBL236438 1.00 ALDH1A1 (0.85) ALDH1A1NR5A2NR5A1SMN1; SMN2MAPT
SCHEMBL79578 1.00 ALDH1A1 (0.85) ALDH1A1NR5A2NR5A1SMN1; SMN2MAPT
SCHEMBL23834444 0.99 NR5A2 (0.83) ALDH1A1NR5A2NR5A1SMN1; SMN2MAPT
SCHEMBL234615 0.99 NR5A2 (0.83) ALDH1A1NR5A2NR5A1SMN1; SMN2MAPT
SCHEMBL233018 0.99 NR5A2 (0.83) ALDH1A1NR5A2NR5A1SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116087487-B Biomarkers for early prediction of cardiovascular disease (CVD) in diabetics and uses thereof 中国医学科学院阜外医院 2025-06-03 CN disclosed
CN-116087488-B Biomarkers for early prediction of cardiovascular disease (CVD) in diabetics and uses thereof 中国医学科学院阜外医院 2025-06-03 CN disclosed
CN-116087489-B Biomarkers for early prediction of cardiovascular disease (CVD) in diabetics and uses thereof 中国医学科学院阜外医院 2025-06-03 CN disclosed
US-12280114-B2 Extraction of plant source “medicinal soup” and manual preparation of “herbal medicine” and related products INSTITUTE OF BASIC MEDICAL SCIENCES (CN) 2025-04-22 US disclosed
US-20250041423-A1 EXTRACTION OF PLANT SOURCE \"MEDICINAL SOUP\" AND MANUAL PREPARATION OF \"HERBAL MEDICINE\" AND RELATED PRODUCTS BEIJING BAISHIHEKANG PHARMACEUTICAL TECHNOLOGY (BSJPHARMA) CO., LTD (CN) 2025-02-06 US 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-12280114-B2 Extraction of plant source “medicinal soup” and manual preparation of “herbal medicine” and related products CHMP4B, FIP1L1, LIPC ALDH1A1 3396/4885NR5A2 3403/4885NR5A1 2662/4885
US-20250041423-A1 EXTRACTION OF PLANT SOURCE \"MEDICINAL SOUP\" AND MANUAL PREPARATION OF \"HERBAL MEDICINE\" AND RELATED PRODUCTS CHMP4B, EXOSC5, FIP1L1 ALDH1A1 2612/4885NR5A2 3322/4885NR5A1 1983/4885

“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.