SCHEMBL21629314

SCHEMBL21629314

Cc1ccc(NC(=O)c2ccccc2)c(C(=O)c2ccccc2)c1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.73
GAA P10253 1/20 0.73
MAPT P10636 4/20 0.68
MEN1 O00255 1/20 0.68
GFER P55789 1/20 0.68
KMT2A Q03164 1/20 0.68
LMNA P02545 2/20 0.65
HTT P42858 2/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
PKM P14618 1/20 0.64
NPSR1 Q6W5P4 2/20 0.63
KCNMA1 Q12791 1/20 0.63
ALDH1A1 P00352 2/20 0.58
NPC1 O15118 1/20 0.58
CYP1A2 P05177 1/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
RAB9A P51151 1/20 0.58
LTC4S Q16873 1/20 0.56

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
SCHEMBL11834604 0.89 MEN1 (0.85) MAPTMEN1GFERKMT2AHTT
SCHEMBL14884639 0.88 MEN1 (0.68) TP53GAAMAPTMEN1GFER
SCHEMBL3456170 0.86 TP53 (0.71) TP53GAAMAPTMEN1GFER
SCHEMBL2921293 0.85 PKM (0.64) TP53GAAMAPTMEN1GFER
SCHEMBL5381695 0.84 MAPT (0.72) TP53GAAMAPTMEN1KMT2A
SCHEMBL16317646 0.83 KCNMA1 (0.76) MAPTMEN1GFERKMT2ASMN1; SMN2
SCHEMBL13440495 0.82 TP53 (0.60) TP53GAAMAPTMEN1GFER
SCHEMBL11727445 0.82 PKM (0.73) TP53GAAMAPTLMNAHTT
SCHEMBL8820818 0.82 MAPT (0.71) TP53GAAMAPTMEN1GFER
SCHEMBL7752909 0.81 MAPT (0.68) TP53MAPTMEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10993938-B2 Lactam compound, preparation method and use thereof OCEAN UNIVERSITY OF CHINA (CN) 2021-05-04 US disclosed
US-20200030312-A1 Lactam Compound, Preparation Method and Use thereof OCEAN UNIVERSITY OF CHINA (CN) 2020-01-30 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-20200030312-A1 Lactam Compound, Preparation Method and Use thereof FURIN, PEPD, PIN1 TP53 3728/4885GAA 535/4885MAPT 16/4885
US-10993938-B2 Lactam compound, preparation method and use thereof FURIN, PEPD, PIN1 TP53 3728/4885GAA 535/4885MAPT 16/4885

“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.