SCHEMBL25527385

SCHEMBL25527385

O=C(CS)Oc1c(I)cc(I)cc1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.39
POLB P06746 1/20 0.37
NLRP3 Q96P20 1/20 0.37
TPMT P51580 1/20 0.32
PTPRC P08575 1/20 0.31
PTPN2 P17706 1/20 0.31
PTPN1 P18031 1/20 0.31
PTPRA P18433 1/20 0.31
PTPRB P23467 1/20 0.31
PTPRE P23469 1/20 0.31
PTPN6 P29350 1/20 0.31

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
SCHEMBL25527397 0.90 MAOB (0.35) MAOBPOLBNLRP3
SCHEMBL25527337 0.88 MAOB (0.37) MAOBPOLBNLRP3TPMT
SCHEMBL19678546 0.85 MAOB (0.40) MAOBPOLBNLRP3TPMTPTPRC
SCHEMBL25529015 0.84
SCHEMBL19678534 0.84 POLB (0.40) MAOBPOLBNLRP3TPMTPTPRC
SCHEMBL19678548 0.83 MAOB (0.38) MAOBPOLBNLRP3TPMTPTPRC
SCHEMBL25527345 0.81 MAOB (0.35) MAOB
SCHEMBL19683952 0.80 MAOB (0.36) MAOBPOLBNLRP3
SCHEMBL19678550 0.80 MAOB (0.36) MAOBPOLBNLRP3
SCHEMBL25527372 0.78 TPMT (0.49) POLBTPMT

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