SCHEMBL26312898

SCHEMBL26312898

C=C(C)c1ccc(OCCS(=O)(=O)O)cc1I

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRA P10827 2/20 0.40
THRB P10828 2/20 0.40
MAOB P27338 10/20 0.34
ALDH1A1 P00352 2/20 0.34
LMNA P02545 2/20 0.34
POLB P06746 2/20 0.34
RAB9A P51151 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
KDM4E B2RXH2 2/20 0.34
PPARD Q03181 1/20 0.34
NPC1 O15118 1/20 0.34
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.34
BRCA1 P38398 1/20 0.34
HTT P42858 1/20 0.34
GMNN O75496 1/20 0.34
PKM P14618 1/20 0.34
THPO P40225 1/20 0.34
MTOR P42345 1/20 0.34
RECQL P46063 1/20 0.34

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
SCHEMBL26312897 0.76 S1PR3 (0.31)
SCHEMBL26312923 0.75
SCHEMBL26312959 0.73 POLB (0.33) THRATHRBALDH1A1LMNAPOLB
SCHEMBL17274189 0.73 ALDH1A1 (0.51) ALDH1A1LMNAPOLBRAB9ASMN1; SMN2
SCHEMBL26312925 0.72 BPTF (0.32) THRATHRBALDH1A1LMNAPOLB
SCHEMBL26312907 0.72 THRA (0.40) THRATHRB
SCHEMBL26312838 0.72
SCHEMBL19846329 0.72 ALDH1A1 (0.45) ALDH1A1LMNAPOLBRAB9ASMN1; SMN2
SCHEMBL31338897 0.72 ALDH1A1 (0.46) THRBALDH1A1LMNARAB9ASMN1; SMN2
SCHEMBL12468575 0.71 ALDH1A1 (0.50) ALDH1A1LMNAPOLBRAB9ASMN1; SMN2

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-20230296981-A1 RESIST MATERIAL AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-09-21 US disclosed
US-20230296980-A1 RESIST MATERIAL AND PATTERN FORMING METHOD SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-09-21 US disclosed