SCHEMBL25734158

SCHEMBL25734158

CCS(=O)(=O)Nc1ccc(C(=O)O)nc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P4HTM Q9NXG6 13/20 0.50
▸ HPGD P15428 5/20 0.50
▸ LMNA P02545 3/20 0.50
▸ KDM4E B2RXH2 2/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ PKM P14618 1/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ NFKB1 P19838 1/20 0.46
▸ THPO P40225 1/20 0.46
▸ BLM P54132 1/20 0.46
▸ PMP22 Q01453 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL3187466 0.83 P4HTM (0.58) P4HTMKDM4EL3MBTL1ALDH1A1MAPK1
SCHEMBL18405340 0.78 P4HTM (0.60) P4HTMLMNAKDM4EL3MBTL1MEN1
SCHEMBL30112058 0.78 P4HTM (0.60) P4HTMLMNAKDM4EL3MBTL1MEN1
SCHEMBL25734156 0.78 HPGD (0.46) HPGDLMNAKDM4EL3MBTL1MEN1
SCHEMBL13954312 0.75 P4HTM (0.61) P4HTMLMNAKDM4EL3MBTL1MEN1
SCHEMBL3631360 0.75 P4HTM (0.58) P4HTMHPGDALDH1A1MAPTSMN1; SMN2
Fluorobenzene SCHEMBL27404458 0.75 P4HTM (0.50) P4HTMKDM4EMEN1ALDH1A1KMT2A
SCHEMBL23832337 0.75 HPGD (0.50) HPGDLMNAKDM4EL3MBTL1ALDH1A1
SCHEMBL30088475 0.75 HPGD (0.50) HPGDLMNAKDM4EL3MBTL1ALDH1A1
SCHEMBL1017480 0.74 HPGD (0.72) HPGDLMNAL3MBTL1ALDH1A1MAPT

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 1 patent. 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

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 P4HTM 507/4885HPGD 43/4885LMNA 2111/4885

“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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