SCHEMBL31335562

SCHEMBL31335562

Cc1c(Cl)c(OC(F)F)cc2c1C(=O)OC(C)(C)O2

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GRIA1 P42261 1/20 0.31
CACNG8 Q8WXS5 1/20 0.31
TSHR P16473 1/20 0.30

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
SCHEMBL31335604 0.83 TDP1 (0.43) TDP1L3MBTL1TSHR
SCHEMBL31335652 0.75 TDP1 (0.36) TDP1L3MBTL1TSHR
SCHEMBL27032900 0.73 ALDH1A1 (0.40) TDP1L3MBTL1TSHR
SCHEMBL26604723 0.70 TDP1 (0.36) TDP1L3MBTL1TSHR
SCHEMBL26604780 0.67 ALDH1A1 (0.38) TDP1L3MBTL1TSHR
SCHEMBL26604867 0.65 TDP1 (0.34) TDP1L3MBTL1TSHR
SCHEMBL26604963 0.65 TDP1 (0.34) TDP1L3MBTL1TSHR
SCHEMBL16072319 0.64 PDE4B (0.35) TDP1TSHR
SCHEMBL1640544 0.63 TDP1 (0.39) TDP1L3MBTL1TSHR
SCHEMBL13083105 0.63 TDP1 (0.39) TDP1L3MBTL1TSHR

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-4720038-A1 (HETERO)ARYL-CARBONYL-HETEROBICYCLIC COMPOUNDS AS INHIBITORS OF PMS2 FOR CANCER AND DEGENERATIVE ILLNESSES Neophore Limited (GB) 2026-04-08 EP disclosed
WO-2024246496-A1 (HETERO)ARYL-CARBONYL-HETEROBICYCLIC COMPOUNDS AS INHIBITORS OF PMS2 FOR CANCER AND DEGENERATIVE ILLNESSES Neophore Limited (GB) 2024-12-05 WO disclosed