SCHEMBL25527340

SCHEMBL25527340

O=C(CS)OCCOc1ccc(C(=O)O)cc1I

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.45
PLAU P00749 1/20 0.45
ST14 Q9Y5Y6 1/20 0.45
POLB P06746 1/20 0.45
CASP6 P55212 1/20 0.45
THRA P10827 1/20 0.43
THRB P10828 1/20 0.43
TTR P02766 1/20 0.41
HTT P42858 1/20 0.40
PKM P14618 1/20 0.40
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.38
PTPN11 Q06124 1/20 0.38
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38

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
SCHEMBL25527342 0.81 TPMT (0.43) PLAUHTTPKM
SCHEMBL25527371 0.81 TSHR (0.44) TTRHTTALDH1A1TSHR
SCHEMBL566129 0.78 THRA (0.56) F2PLAUST14POLBCASP6
SCHEMBL25788111 0.75 THRA (0.68) THRATHRBALDH1A1HPGDTSHR
SCHEMBL25788106 0.75 THRA (0.68) THRATHRBALDH1A1HPGDTSHR
SCHEMBL25788104 0.75 THRA (0.68) THRATHRBALDH1A1HPGDTSHR
SCHEMBL25788109 0.75 THRA (0.68) THRATHRBALDH1A1HPGDTSHR
SCHEMBL25527374 0.75 ALDH1A1 (0.43) PKMALDH1A1
SCHEMBL25527373 0.74 PLA2G2A (0.44) POLBCASP6HTTPKM
SCHEMBL4948306 0.74 TSHR (0.66) POLBCASP6THRATHRBTTR

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