SCHEMBL25527929

SCHEMBL25527929

Bc1ccc(F)c(C(=O)OCCS(=O)(=O)O)c1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.38
▸ SERPINE1 P05121 1/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ GAA P10253 1/20 0.32
▸ TSHR P16473 3/20 0.31
▸ HPGD P15428 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ CES2 O00748 1/20 0.31
▸ CES1 P23141 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ TDP1 Q9NUW8 2/20 0.30
▸ L3MBTL1 Q9Y468 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
SCHEMBL25527915 0.85 CA12 (0.43) SERPINE1RXFP1ALDH1A1GAAHPGD
SCHEMBL25737060 0.83 MAPK1 (0.34) MAPK1SERPINE1RXFP1ALDH1A1GAA
SCHEMBL25527926 0.83 CYP4F2 (0.40) RXFP1ALDH1A1TSHRHPGDPOLB
SCHEMBL25527920 0.83 SERPINE1 (0.33) SERPINE1ALDH1A1GAATSHRTDP1
SCHEMBL19756075 0.83 MAPK1 (0.35) MAPK1SERPINE1RXFP1ALDH1A1GAA
SCHEMBL25476195 0.83 NPC1 (0.38) MAPK1MAPTALDH1A1GAATSHR
SCHEMBL25527934 0.83 ALDH1A1 (0.38) MAPK1SERPINE1MAPTALDH1A1GAA
SCHEMBL18775946 0.79 ALDH1A1 (0.46) MAPK1ALDH1A1TSHRCES2CES1
SCHEMBL18776010 0.79 CES2 (0.47) MAPK1SERPINE1ALDH1A1GAATSHR
SCHEMBL18775891 0.77 RAB9A (0.49) SERPINE1MAPTALDH1A1GAATSHR

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-20230152696-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-18 — — US disclosed
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