SCHEMBL25527375

SCHEMBL25527375

O=C(CS)OCCOc1cc(F)ccc1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
KMT2A Q03164 3/20 0.44
PTK2B Q14289 1/20 0.44
DCLRE1B Q9H816 1/20 0.41
FFAR4 Q5NUL3 1/20 0.40
LTB4R Q15722 1/20 0.40
LTB4R2 Q9NPC1 1/20 0.40
ATM Q13315 1/20 0.39
RARA P10276 1/20 0.39
RARB P10826 1/20 0.39
POLB P06746 1/20 0.38
KEAP1 Q14145 1/20 0.37
METTL3 Q86U44 2/20 0.36
METTL14 Q9HCE5 2/20 0.36
MEN1 O00255 2/20 0.36

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
SCHEMBL25527330 0.84 ALDH1A1 (0.46) ALDH1A1KMT2APTK2BDCLRE1BFFAR4
SCHEMBL25527377 0.83 TSHR (0.44) ALDH1A1KMT2APTK2BMEN1
SCHEMBL25527374 0.83 ALDH1A1 (0.43) ALDH1A1KMT2APTK2BATMRARA
SCHEMBL25529019 0.83 ALDH1A1 (0.52) ALDH1A1KMT2A
SCHEMBL25527365 0.81 DCLRE1B (0.42) ALDH1A1KMT2APTK2BDCLRE1BFFAR4
SCHEMBL25345347 0.80 ALDH1A1 (0.49) ALDH1A1KMT2APTK2BFFAR4LTB4R
SCHEMBL12466431 0.79 ALDH1A1 (0.47) ALDH1A1KMT2APTK2BFFAR4LTB4R
SCHEMBL25527388 0.79 ALDH1A1 (0.46) ALDH1A1KMT2AMEN1
SCHEMBL28826108 0.76 KEAP1 (0.46) ALDH1A1KMT2APTK2BDCLRE1BFFAR4
SCHEMBL20471860 0.75 PTPN11 (0.52) KMT2ALTB4RLTB4R2RARARARB

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