SCHEMBL19756172

SCHEMBL19756172

O=C(OCC(F)(F)S(=O)(=O)O)c1ccc(OC(=O)c2cc(I)cc(I)c2I)cc1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.32
▸ TRPV1 Q8NER1 1/20 0.32
▸ STS P08842 2/20 0.31
▸ ACR P10323 3/20 0.31
▸ PRSS1 P07477 2/20 0.31
▸ RARA P10276 1/20 0.31
▸ RARB P10826 1/20 0.31
▸ MAPK1 P28482 1/20 0.30
▸ HIF1A Q16665 1/20 0.30
▸ MAPT P10636 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
SCHEMBL27277902 0.90 KMT2A (0.34) KMT2AMEN1NPSR1ALDH1A1STS
SCHEMBL19756183 0.90 — —
SCHEMBL19756175 0.86 NPSR1 (0.33) KMT2AMEN1NPSR1
SCHEMBL23065534 0.86 HDAC3 (0.33) —
SCHEMBL19756180 0.84 — —
SCHEMBL19756201 0.81 STS (0.36) KMT2AMEN1ALDH1A1STSRARA
SCHEMBL19756196 0.79 ELANE (0.32) TRPV1
SCHEMBL24054834 0.79 KMT2A (0.34) KMT2AALDH1A1TRPV1STSRARA
SCHEMBL27277900 0.79 SERPINE1 (0.42) KMT2AMEN1NPSR1ACRPRSS1
SCHEMBL19756169 0.79 NPSR1 (0.37) KMT2AMEN1NPSR1

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-20170369616-A1 RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-12-28 — — US disclosed
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