SCHEMBL30482379

SCHEMBL30482379

Cn1c(=O)n(Cc2ccccc2C(F)(F)F)c(=O)c2c(-c3cc(O)cnc3C(N)=O)ccc(F)c21

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HSD17B13 Q7Z5P4 5/20 0.39
▸ GNRHR P30968 2/20 0.38
▸ GRIN1 Q05586 1/20 0.36
▸ GRIN2B Q13224 1/20 0.36
▸ CMA1 P23946 2/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ SCD O00767 1/20 0.35
▸ PLK1 P53350 1/20 0.35
▸ KIF11 P52732 2/20 0.35
▸ PARG Q86W56 2/20 0.34

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
SCHEMBL30482281 0.81 TDP1 (0.40) HSD17B13GNRHRCMA1TDP1SCD
SCHEMBL30482353 0.76 GNRHR (0.43) HSD17B13GNRHRCMA1TDP1PARG
SCHEMBL31227182 0.74 TSHR (0.41) HSD17B13GNRHRCMA1TDP1PARG
SCHEMBL26230397 0.70 HSD17B13 (0.45) HSD17B13GNRHRCMA1PARG
SCHEMBL25433299 0.69 HSD17B13 (0.74) HSD17B13
SCHEMBL30482276 0.69 HSD17B13 (0.74) HSD17B13
SCHEMBL30482328 0.65 RORC (0.40) HSD17B13SCDKIF11
SCHEMBL30482352 0.62 TSHR (0.55) TDP1PARG
SCHEMBL31333054 0.60 ALDH1A1 (0.47) TDP1SCDPLK1
SCHEMBL6256477 0.60 MMP13 (0.41) CMA1PARG

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
EP-4469451-A1 2-SUBSTITUTED THIAZOLE HSD17B13 INHIBITORS AND USES THEREOF Inipharm, Inc. (US) 2024-12-04 — — EP disclosed
WO-2023146897-A1 2-SUBSTITUTED THIAZOLE HSD17B13 INHIBITORS AND USES THEREOF INIPHARM, INC. (US) 2023-08-03 — — WO disclosed
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