SCHEMBL839404

SCHEMBL839404

CCNC(CC(C)C)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.59
MEN1 O00255 1/20 0.59
LMNA P02545 1/20 0.59
KMT2A Q03164 1/20 0.59
MAPT P10636 1/20 0.55
FOLH1 Q04609 6/20 0.52
NAALAD2 Q9Y3Q0 2/20 0.47
PLA2G2A P14555 2/20 0.46
PLA2G5 P39877 2/20 0.46
MMP3 P08254 1/20 0.45
LAP3 P28838 3/20 0.44
FPR2 P25090 2/20 0.44
RNPEP Q9H4A4 1/20 0.43

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
SCHEMBL7130634 1.00 ALDH1A1 (0.59) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL3451868 1.00 ALDH1A1 (0.59) ALDH1A1MEN1LMNAKMT2AMAPT
Hydrochloric Acid SCHEMBL23833941 0.98 ALDH1A1 (0.57) ALDH1A1MEN1LMNAKMT2AMAPT
Hydrochloric Acid SCHEMBL23833944 0.98 ALDH1A1 (0.57) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL29233119 0.90 ALDH1A1 (0.50) ALDH1A1MEN1LMNAKMT2AMAPT
Monoethanolamine SCHEMBL28349826 0.89 ALDH1A1 (0.49) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL1527332 0.83 ALDH1A1 (0.53) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL1527333 0.83 ALDH1A1 (0.53) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL2121537 0.82 MAPT (0.60) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL7563707 0.82 ALDH1A1 (0.57) ALDH1A1MEN1LMNAKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250066409-A1 DERIVATIVE OF PENTACYCLIC TRITERPENOIDAL SAPONIN AND ITS PREPARATION METHOD AND APPLICATION SOOCHOW UNIVERSITY (CN) 2025-02-27 US claimed
CN-117858892-A Compositions and methods for treating and/or preventing proteinopathies 恢复治疗瑞典公司 2024-04-09 CN claimed
CN-115304516-A Compounds with unconventional chromophores, their preparation and use 四川大学 2022-11-08 CN claimed
CN-101601634-B Infant anus skin care solution ZHANG JIEYU 2012-07-18 CN claimed
CN-101601634-A Infant anus skin care solution YULIN ZHANG (CN) 2009-12-16 CN claimed
US-6117841-A USED TO TREAT STROKE, CEREBRAL ISCHEMIA, PAIN, HEAD TRAUMA OR EPILEPSY WARNER-LAMBERT COMPANY (US) 2000-09-12 US claimed
WO-1998054123-A1 SUBSTITUTED PEPTIDYLAMINE CALCIUM CHANNEL BLOCKERS WARNER-LAMBERT COMPANY (US) 1998-12-03 WO claimed
CN-119667035-A Method for rapidly detecting chiral substances in white spirit and fermented grains and application 宜宾五粮液股份有限公司 2025-03-21 CN disclosed
US-20250066409-A1 DERIVATIVE OF PENTACYCLIC TRITERPENOIDAL SAPONIN AND ITS PREPARATION METHOD AND APPLICATION SOOCHOW UNIVERSITY (CN) 2025-02-27 US disclosed
CN-118382612-A Method for producing blocked isocyanate compound and method for producing isocyanate compound 旭化成株式会社 2024-07-23 CN disclosed
CN-115304516-B Compounds with unconventional chromophores, their preparation and use 四川大学 2024-04-30 CN disclosed
CN-117858892-A Compositions and methods for treating and/or preventing proteinopathies 恢复治疗瑞典公司 2024-04-09 CN disclosed
WO-2023125182-A1 PROPIONIC ACID DERIVATIVE AND MEDICAL USE THEREOF 海思科医药集团股份有限公司 2023-07-06 WO disclosed
EP-0392619-B1 Malodors reduction QUEST INT (NL) 1995-06-21 EP disclosed
EP-0647449-A1 Sustained-release preparation of anti-endothelin substance Takeda Chemical Industries, Ltd. (JP) 1995-04-12 EP disclosed
EP-0626174-A2 Methods and compositions for the prophylactic and/or therapeutic treatment of organ hypofunction TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-11-30 EP disclosed
EP-0552417-A1 Cyclic peptides and use thereof TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-07-28 EP disclosed
US-5204023-A Trapping with reaction product(Schiff base) of desirable aldehyde and amine; soaps, detergents, foods UNILEVER PATENT HOLDINGS B.V. (NL) 1993-04-20 US disclosed
EP-0528312-A2 Cyclic peptides and use thereof TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-02-24 EP disclosed
EP-0392619-A2 Malodors reduction QUEST INTERNATIONAL B.V. (NL) 1990-10-17 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 (1 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-20250066409-A1 DERIVATIVE OF PENTACYCLIC TRITERPENOIDAL SAPONIN AND ITS PREPARATION METHOD AND APPLICATION CASP4, CASP3, CASP14 ALDH1A1 2333/4885MEN1 2743/4885LMNA 3451/4885

“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.