SCHEMBL29998947

SCHEMBL29998947

Cc1nc2c(=O)oc(-c3ccc(O)c(Cl)c3)nc2s1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 8/20 0.44
▸ ESR1 P03372 7/20 0.44
▸ KDM4E B2RXH2 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ NPC1 O15118 2/20 0.38
▸ PBRM1 Q86U86 1/20 0.37
▸ PTGS2 P35354 1/20 0.37
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ HSD17B1 P14061 1/20 0.35
▸ HSD17B2 P37059 1/20 0.35
▸ MAPT P10636 1/20 0.33
▸ POLB P06746 1/20 0.33

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
SCHEMBL27087469 1.00 ESR2 (0.44) ESR2ESR1KDM4EALDH1A1NPC1
SCHEMBL27255292 0.78 ALOX5 (0.40) ESR2ESR1PTGS2MEN1KMT2A
SCHEMBL30500261 0.75 ESR1 (0.46) ESR2ESR1KDM4EALDH1A1NPC1
SCHEMBL25211145 0.75 ESR1 (0.46) ESR2ESR1KDM4EALDH1A1NPC1
SCHEMBL30500299 0.73 ESR2 (0.42) ESR2ESR1KDM4EALDH1A1NPC1
SCHEMBL25202116 0.73 ESR2 (0.42) ESR2ESR1KDM4EALDH1A1NPC1
SCHEMBL25195367 0.71 SMN1; SMN2 (0.65) KDM4EALDH1A1NPC1MEN1KMT2A
SCHEMBL30500265 0.71 SMN1; SMN2 (0.65) KDM4EALDH1A1NPC1MEN1KMT2A
SCHEMBL25202713 0.70 MAPT (0.60) ESR2ESR1KDM4EALDH1A1NPC1
SCHEMBL30500214 0.70 MAPT (0.60) ESR2ESR1KDM4EALDH1A1NPC1

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-20240208959-A1 THIAZOLE/ISOTHIAZOLE HSD17B13 INHIBITORS AND USES THEREOF INIPHARM, INC. 2024-06-27 — — US disclosed
EP-4319872-A1 THIAZOLE/ISOTHIAZOLE HSD17B13 INHIBITORS AND USES THEREOF Inipharm, Inc. (US) 2024-02-14 — — EP disclosed
WO-2022216627-A1 THIAZOLE/ISOTHIAZOLE HSD17B13 INHIBITORS AND USES THEREOF INIPHARM, INC. (US) 2022-10-13 — — 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-20240208959-A1 THIAZOLE/ISOTHIAZOLE HSD17B13 INHIBITORS AND USES THEREOF HSD17B1, HSD17B3, HSD17B13 ESR2 1654/4885ESR1 2070/4885KDM4E 4467/4885

“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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