SCHEMBL25072803

SCHEMBL25072803

O=C(O)C1CCCN(S(=O)(=O)c2cnc(-c3ccc(F)cc3)s2)C1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.61
▸ TSHR P16473 2/20 0.55
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ AKR1C3 P42330 5/20 0.48
▸ AKR1C1 Q04828 2/20 0.48
▸ KMT2A Q03164 3/20 0.46
▸ ALDH1A1 P00352 2/20 0.45
▸ LMNA P02545 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ GLA P06280 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ TP53 P04637 1/20 0.43
▸ MEN1 O00255 1/20 0.43

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
SCHEMBL25072808 0.87 POLB (0.50) MAPTTSHRL3MBTL1KMT2AALDH1A1
SCHEMBL25073010 0.79 MAPT (0.61) MAPTTSHRL3MBTL1AKR1C3AKR1C1
SCHEMBL5245498 0.77 MAPT (1.00) MAPTL3MBTL1AKR1C3AKR1C1KMT2A
SCHEMBL25072802 0.73 ALDH1A1 (0.44) KMT2AALDH1A1HTT
SCHEMBL25734897 0.73 ALDH1A1 (0.44) KMT2AALDH1A1HTT
SCHEMBL25073051 0.73 ALDH1A1 (0.44) KMT2AALDH1A1HTT
SCHEMBL5244961 0.72 TSHR (1.00) MAPTTSHRL3MBTL1AKR1C3AKR1C1
SCHEMBL25072801 0.71 TAS2R14 (0.35) MAPTKMT2AALDH1A1SMN1; SMN2NPSR1
SCHEMBL5243826 0.70 MEN1 (0.72) TSHRL3MBTL1KMT2AALDH1A1HTT
SCHEMBL5282637 0.70 MEN1 (0.72) TSHRL3MBTL1KMT2AALDH1A1HTT

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 3 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
WO-2023023310-A1 17-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 13 INHIBITORS AND METHODS OF USE THEREOF ENANTA PHARMACEUTICALS, INC. (US) 2023-02-23 — — 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-20230143250-A1 17-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 13 INHIBITORS AND METHODS OF USE THEREOF HSD17B1, HSD17B13, HSD17B3 MAPT 3642/4885TSHR 3945/4885L3MBTL1 4718/4885

“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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