SCHEMBL25979882

SCHEMBL25979882

NC(Cc1cc(I)ccc1O)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 7/20 0.62
LMNA P02545 5/20 0.62
KDM4E B2RXH2 4/20 0.62
KMT2A Q03164 4/20 0.62
USP2 O75604 3/20 0.62
ALOX15 P16050 3/20 0.62
HSD17B10 Q99714 3/20 0.62
HIF1A Q16665 3/20 0.62
NPSR1 Q6W5P4 3/20 0.62
MEN1 O00255 3/20 0.62
MAPT P10636 3/20 0.62
BLM P54132 3/20 0.62
PMP22 Q01453 3/20 0.62
RECQL P46063 2/20 0.62
TDP1 Q9NUW8 2/20 0.62
CYP3A4 P08684 2/20 0.62
PKM P14618 2/20 0.62
NFKB1 P19838 2/20 0.62
ALDH1A1 P00352 2/20 0.62
RGS12 O14924 1/20 0.62

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
SCHEMBL8540405 0.83 KDM4E (0.66) THRBLMNAKDM4EKMT2AUSP2
SCHEMBL5286425 0.83 KDM4E (0.66) THRBLMNAKDM4EKMT2AUSP2
SCHEMBL25177946 0.82 USP2 (0.47) THRBLMNAKDM4EKMT2AUSP2
SCHEMBL25185929 0.82 USP2 (0.47) THRBLMNAKDM4EKMT2AUSP2
SCHEMBL25264034 0.82 USP2 (0.47) THRBLMNAKDM4EKMT2AUSP2
SCHEMBL25173130 0.82 KDM4E (0.51) THRBLMNAKDM4EKMT2AUSP2
SCHEMBL25186419 0.82 KDM4E (0.47) THRBLMNAKDM4EKMT2AUSP2
SCHEMBL25264658 0.82 KDM4E (0.47) THRBLMNAKDM4EKMT2AUSP2
SCHEMBL25173129 0.82 KDM4E (0.51) THRBLMNAKDM4EKMT2AUSP2
SCHEMBL25177948 0.82 USP2 (0.47) THRBLMNAKDM4EKMT2AUSP2

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
WO-2023150197-A1 ARYL HYDROCARBON RECEPTOR AGONISTS AND USES THEREOF NEXYS THERAPEUTICS, INC. (US) 2023-08-10 WO disclosed