SCHEMBL17849024

SCHEMBL17849024

CC(=O)N(c1ccc(O)cc1)C(C(=O)NCC(=O)O)C(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
MAPT P10636 2/20 0.38
LMNA P02545 1/20 0.38
PTGS2 P35354 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ECE1 P42892 2/20 0.38
MME P08473 6/20 0.37
ACE P12821 4/20 0.37
CPA1 P15085 1/20 0.34
ACE2 Q9BYF1 1/20 0.34
OPRD1 P41143 5/20 0.33
OPRM1 P35372 4/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 1/20 0.33
HSD17B10 Q99714 1/20 0.33
OPRK1 P41145 1/20 0.33
MEN1 O00255 1/20 0.33
BLM P54132 1/20 0.33
NPEPPS P55786 1/20 0.33
KMT2A Q03164 1/20 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
SCHEMBL17849025 1.00 ALDH1A1 (0.38) ALDH1A1MAPTLMNAPTGS2TDP1
SCHEMBL3747440 0.89 MME (0.45) ALDH1A1MAPTLMNAPTGS2TDP1
SCHEMBL17860525 0.88 MAPT (0.37) ALDH1A1MAPTLMNAPTGS2TDP1
SCHEMBL17848960 0.85 MME (0.37) ALDH1A1MAPTLMNAPTGS2TDP1
SCHEMBL17848959 0.85 MME (0.37) ALDH1A1MAPTLMNAPTGS2TDP1
SCHEMBL17849018 0.83 MCL1 (0.39) ALDH1A1MAPTLMNAPTGS2TDP1
SCHEMBL17849016 0.83 MCL1 (0.39) ALDH1A1MAPTLMNAPTGS2TDP1
SCHEMBL17848976 0.82 ALDH1A1 (0.35) ALDH1A1MAPTLMNAPTGS2TDP1
SCHEMBL17848978 0.82 ALDH1A1 (0.35) ALDH1A1MAPTLMNAPTGS2TDP1
SCHEMBL17848975 0.80 ALDH1A1 (0.37) ALDH1A1MAPTLMNAPTGS2TDP1

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-107001412-B Compounds of the N-acylamino-amide family, compositions containing them and uses 莱雅公司 2021-03-12 CN disclosed
EP-3233886-B1 COMPOUNDS IN THE FAMILY OF N-ACYLAMINO-AMIDES, COMPOSITIONS COMPRISING THEM, AND USES OREAL (FR) 2020-02-26 EP disclosed
US-20170360667-A1 NEW COMPOUNDS IN THE FAMILY OF N-ACYLAMINO-AMIDES, COMPOSITIONS COMPRISING THEM, AND USES L'OREAL (FR) 2017-12-21 US disclosed
EP-3233886-A1 COMPOUNDS IN THE FAMILY OF N-ACYLAMINO-AMIDES, COMPOSITIONS COMPRISING THEM, AND USES L'Oréal (FR) 2017-10-25 EP disclosed
WO-2016096804-A1 COMPOUNDS IN THE FAMILY OF N-ACYLAMINO-AMIDES, COMPOSITIONS COMPRISING THEM, AND USES L'OREAL (FR) 2016-06-23 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 (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-20170360667-A1 NEW COMPOUNDS IN THE FAMILY OF N-ACYLAMINO-AMIDES, COMPOSITIONS COMPRISING THEM, AND USES H1-0, CRY1, CCNA1 ALDH1A1 736/4885MAPT 3886/4885LMNA 491/4885

“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.