SCHEMBL20576754

SCHEMBL20576754

CCCCC(=O)N1C(=O)OC[C@@H]1c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 4/20 0.53
NPC1 O15118 1/20 0.47
LMNA P02545 1/20 0.47
TP53 P04637 1/20 0.47
HPGD P15428 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
HTT P42858 1/20 0.41
RIPK1 Q13546 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
IL6ST P40189 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.39
ELANE P08246 1/20 0.39
PLA2G1B P04054 1/20 0.39
PLA2G2A P14555 1/20 0.39
GLS O94925 1/20 0.38

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
SCHEMBL20576756 1.00 NAAA (0.53) NAAANPC1LMNATP53HPGD
SCHEMBL28325329 0.96 NAAA (0.55) NAAANPC1LMNATP53HPGD
SCHEMBL13340721 0.92 NAAA (0.49) NAAANPC1LMNATP53HPGD
SCHEMBL19810282 0.92 NAAA (0.57) NAAANPC1LMNATP53HPGD
SCHEMBL18007116 0.92 NAAA (0.57) NAAANPC1LMNATP53HPGD
SCHEMBL16812551 0.88 NAAA (0.52) NAAANPC1LMNATP53HPGD
SCHEMBL12275577 0.88 NAAA (0.52) NAAANPC1LMNATP53HPGD
SCHEMBL18006657 0.88 NAAA (0.54) NAAANPC1LMNATP53HPGD
SCHEMBL18006656 0.88 NAAA (0.54) NAAANPC1LMNATP53HPGD
SCHEMBL6952741 0.86 NPC1 (0.51) NAAANPC1LMNATP53HPGD

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
US-20210163410-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF (2S)-2-[(4R)-2-OXO-4-PROPYLTETRAHYDRO-1H-PYRROL-1-YL] BUTANAMIDE AND ITS INTERMEDIATES THEREOF MSN LABORATORIES PRIVATE LIMITED, R&D CENTER (IN) 2021-06-03 US disclosed
US-20210163410-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF (2S)-2-[(4R)-2-OXO-4-PROPYLTETRAHYDRO-1H-PYRROL-1-YL] BUTANAMIDE AND ITS INTERMEDIATES THEREOF MSN LABORATORIES PRIVATE LIMITED, R&D CENTER (IN) 2021-06-03 US disclosed
US-10975050-B2 Process for preparing optically pure (R)-4-n-propyl-dihydrofuran-2(3H)-one BEIJING ABLEPHARMTECH CO., LTD. (CN) 2021-04-13 US disclosed
WO-2018220646-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF (2S)-2-[(4R)-2-OXO-4-PROPYLTETRAHYDRO-1H-PYRROL-1-YL] BUTANAMIDE AND ITS INTERMEDIATES THEREOF MSN LABORATORIES PRIVATE LIMITED, R&D CENTER (IN) 2018-12-06 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 (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-20210163410-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF (2S)-2-[(4R)-2-OXO-4-PROPYLTETRAHYDRO-1H-PYRROL-1-YL] BUTANAMIDE AND ITS INTERMEDIATES THEREOF SCN1B, CACNA1B, CACNA1D NAAA 1720/4885NPC1 2656/4885LMNA 2925/4885
US-10975050-B2 Process for preparing optically pure (R)-4-n-propyl-dihydrofuran-2(3H)-one DCXR, HPD, PGLS NAAA 1770/4885NPC1 4335/4885LMNA 923/4885

“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.