SCHEMBL17860463

SCHEMBL17860463

CC(=O)N(c1cccc(C#N)c1)C(C(=O)NCC(=O)O)C(C)C

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GPR139 Q6DWJ6 1/20 0.42
EGLN1 Q9GZT9 3/20 0.39
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
GLO1 Q04760 1/20 0.36
ALDH1A1 P00352 1/20 0.36
FFAR1 O14842 1/20 0.36
KCNN4 O15554 1/20 0.36
KCNA5 P22460 1/20 0.36
ADAMTS4 O75173 1/20 0.35
S1PR3 Q99500 1/20 0.35
MAOB P27338 1/20 0.35
GSK3B P49841 2/20 0.35
MMP12 P39900 1/20 0.35
MMP13 P45452 1/20 0.35
ACE P12821 1/20 0.34
MME P08473 1/20 0.34

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
SCHEMBL17860521 0.86 PDCD1 (0.40) GPR139EGLN1LMNAMAPTALDH1A1
SCHEMBL21761326 0.86 GPR139 (0.37) GPR139LMNAMAPTALDH1A1KCNN4
SCHEMBL21761324 0.85 GSK3B (0.39) GPR139LMNAMAPTALDH1A1ADAMTS4
SCHEMBL17848959 0.84 MME (0.37) LMNAMAPTALDH1A1ACEMME
SCHEMBL17848960 0.84 MME (0.37) LMNAMAPTALDH1A1ACEMME
SCHEMBL3747440 0.83 MME (0.45) LMNAMAPTALDH1A1ACEMME
SCHEMBL29600045 0.80 GPR139 (0.42) GPR139ALDH1A1
SCHEMBL942690 0.80 GPR139 (0.42) GPR139ALDH1A1
SCHEMBL1170578 0.80 GPR139 (0.42) GPR139ALDH1A1
SCHEMBL17848976 0.77 ALDH1A1 (0.35) EGLN1LMNAMAPTALDH1A1ACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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
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 GPR139 1826/4885EGLN1 567/4885LMNA 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.