SCHEMBL30895805

SCHEMBL30895805

COc1ccc(F)c(F)c1-c1nc(C)ccc1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ CTSA P10619 3/20 0.37
▸ DHODH Q02127 1/20 0.37
▸ ALDH1A1 P00352 3/20 0.36
▸ POLB P06746 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ MYC P01106 1/20 0.36
▸ ACLY P53396 1/20 0.36
▸ NEK2 P51955 2/20 0.35
▸ CDC25B P30305 1/20 0.35
▸ FABP3 P05413 1/20 0.35
▸ FABP4 P15090 1/20 0.35
▸ FABP5 Q01469 1/20 0.35

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
SCHEMBL30895831 0.90 KDM4E (0.39) KDM4ETDP1L3MBTL1LMNAMAPK1
SCHEMBL30895826 0.87 SORT1 (0.43) KDM4ETDP1L3MBTL1LMNAMAPK1
SCHEMBL30895763 0.85 SORT1 (0.37) KDM4ETDP1L3MBTL1LMNAMAPK1
SCHEMBL25308308 0.84 AURKA (0.42) KDM4EHTTCTSADHODHALDH1A1
SCHEMBL25306952 0.78 ALDH1A1 (0.43) KDM4ETDP1L3MBTL1HTTMAPT
SCHEMBL25308518 0.76 DHODH (0.53) KDM4ETDP1L3MBTL1LMNAMAPK1
SCHEMBL25309279 0.76 HSP90AA1 (0.46) KDM4EHTTMAPTCTSAALDH1A1
SCHEMBL30895810 0.74 POLQ (0.46) LMNAMAPK1HTTRAB9ACTSA
SCHEMBL31619676 0.74 NPC1 (0.36) KDM4ERAB9A
SCHEMBL25309836 0.73 KDM4E (0.43) KDM4ECTSAALDH1A1POLBHPGD

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
CN-120152972-A Thiadiazole derivative, composition and application thereof 北京丹擎医药科技有限公司 2025-06-13 — — CN disclosed
WO-2024099336-A1 THIADIAZOLYL DERIVATIVES, COMPOSITIONS AND USES THEREOF DANATLAS PHARMACEUTICALS CO., LTD. (CN) 2024-05-16 — — WO disclosed
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