SCHEMBL24326177

SCHEMBL24326177

CC(C)C[C@@H](N)C(=O)CN(CC(=O)O)Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ANPEP P15144 1/20 0.53
▸ RNPEP Q9H4A4 1/20 0.53
▸ DNPEP Q9ULA0 1/20 0.53
▸ ELANE P08246 1/20 0.44
▸ DPP7 Q9UHL4 2/20 0.43
▸ LARS1 Q9P2J5 1/20 0.42
▸ LTA4H P09960 2/20 0.41
▸ SLC15A1 P46059 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ DPP8 Q6V1X1 1/20 0.41
▸ DPP9 Q86TI2 1/20 0.41
▸ MMP1 P03956 1/20 0.40
▸ MMP3 P08254 1/20 0.40
▸ SLC7A5 Q01650 2/20 0.40
▸ RORC P51449 2/20 0.39
▸ HPGD P15428 1/20 0.39
▸ ALPI P09923 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ PTGS1 P23219 1/20 0.39

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
SCHEMBL24326340 1.00 ANPEP (0.53) ANPEPRNPEPDNPEPELANEDPP7
SCHEMBL27010963 1.00 ANPEP (0.53) ANPEPRNPEPDNPEPELANEDPP7
SCHEMBL10906079 0.80 ANPEP (0.47) ANPEPRNPEPDNPEPLARS1LTA4H
SCHEMBL212272 0.78 AKR1B1 (0.52) MEN1KMT2AMMP1
SCHEMBL5512649 0.76 OPRK1 (0.48) DPP7MEN1KMT2ARORCHPGD
SCHEMBL186172 0.76 MEP1B (0.50) MEN1KMT2AMMP1
SCHEMBL24326677 0.76 REN (0.54) —
SCHEMBL24325756 0.76 REN (0.54) —
SCHEMBL24325748 0.76 REN (0.54) —
Hydrochloric Acid SCHEMBL28542349 0.75 DPP7 (0.47) DPP7SLC15A1MEN1KMT2ADPP8

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-20240018161-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMA (US) 2024-01-18 — — US disclosed
US-20240018161-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMA (US) 2024-01-18 — — US disclosed
US-20240018161-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMA (US) 2024-01-18 — — US disclosed
WO-2022076625-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS INCORPORATED (US) 2022-04-14 — — 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-20240018161-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR CFTR, SCNN1G, SCNN1B ANPEP 3113/4885RNPEP 2992/4885DNPEP 4435/4885

“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.

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