SCHEMBL25734813

SCHEMBL25734813

O=C(O)[C@H]1CC[C@@H](NS(=O)(=O)c2csc(-c3ccc(F)cc3)n2)CC1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.45
▸ ALDH1A1 P00352 3/20 0.44
▸ POLB P06746 4/20 0.40
▸ MAPT P10636 3/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ TLR7 Q9NYK1 1/20 0.40
▸ FAAH O00519 1/20 0.39
▸ EPHX2 P34913 1/20 0.39
▸ VCP P55072 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.37
▸ IDH2 P48735 1/20 0.37
▸ TAS2R14 Q9NYV8 1/20 0.37

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
SCHEMBL25073012 1.00 LMNA (0.45) LMNAALDH1A1POLBMAPTMEN1
SCHEMBL25073368 1.00 LMNA (0.45) LMNAALDH1A1POLBMAPTMEN1
SCHEMBL25073009 0.79 FAAH (0.52) LMNAALDH1A1POLBMAPTKMT2A
SCHEMBL25734897 0.78 ALDH1A1 (0.44) ALDH1A1KMT2AVCPGAAIDH2
SCHEMBL25073051 0.78 ALDH1A1 (0.44) ALDH1A1KMT2AVCPGAAIDH2
SCHEMBL25072802 0.78 ALDH1A1 (0.44) ALDH1A1KMT2AVCPGAAIDH2
SCHEMBL25738984 0.78 LMNA (0.43) LMNAALDH1A1POLBMAPTMEN1
SCHEMBL25072996 0.75 LMNA (0.47) LMNAALDH1A1POLBMAPTMEN1
SCHEMBL29001536 0.75 ALDH1A1 (0.48) LMNAALDH1A1MAPTNPSR1KDM4E
SCHEMBL25073010 0.73 MAPT (0.61) POLBMAPTMEN1KMT2ANPSR1

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-20230143250-A1 17-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 13 INHIBITORS AND METHODS OF USE THEREOF ENANTA PHARMACEUTICALS, INC. 2023-05-11 — — US disclosed
US-20230143250-A1 17-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 13 INHIBITORS AND METHODS OF USE THEREOF ENANTA PHARMACEUTICALS, INC. 2023-05-11 — — 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 (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-20230143250-A1 17-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 13 INHIBITORS AND METHODS OF USE THEREOF HSD17B1, HSD17B13, HSD17B3 LMNA 2111/4885ALDH1A1 125/4885POLB 1547/4885

“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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