SCHEMBL27074591

SCHEMBL27074591

O=Cc1c(S(=O)(=O)O)ccc2cc(O)c(O)cc12

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 12/20 0.44
NT5E P21589 1/20 0.39
MPL P40238 2/20 0.37
CTRC Q99895 1/20 0.37
NSD2 O96028 1/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
HIF1A Q16665 1/20 0.36
HSD17B10 Q99714 1/20 0.36
COMT P21964 1/20 0.36
AURKA O14965 1/20 0.36
AURKB Q96GD4 1/20 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
SCHEMBL129104 0.76 ERN1 (0.59) ERN1MPLCTRCHIF1AHSD17B10
Ammonia Solution, Strong SCHEMBL8762521 0.75 ERN1 (0.58) ERN1MPLCTRCHIF1AHSD17B10
SCHEMBL3726105 0.75 ERN1 (0.58) ERN1MPLCTRCHIF1AHSD17B10
Formaldehyde SCHEMBL10629971 0.74 ERN1 (0.56) ERN1MPLCTRCHIF1AHSD17B10
SCHEMBL3908409 0.74 TDP1 (0.36) ERN1NT5EMPLNSD2LMNA
SCHEMBL2904202 0.72 TTR (0.48) MPLCTRCHSD17B10COMTAURKA
SCHEMBL4942479 0.70 TTR (0.47) MPLCTRCHSD17B10COMTAURKA
SCHEMBL7189933 0.70 TTR (0.32) NT5ELMNAHPGDHIF1AHSD17B10
SCHEMBL428169 0.69 AURKA (0.43) ERN1LMNAHPGDHIF1AHSD17B10
SCHEMBL27566211 0.69 MPL (0.38) NT5EMPLCTRCNSD2LMNA

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
EP-4076841-B1 BONDED ABRASIVE ARTICLE AND METHOD OF MAKING THE SAME 3M INNOVATIVE PROPERTIES COMPANY (US) 2024-01-31 EP claimed