SCHEMBL24899752

SCHEMBL24899752

O=P(c1ccc(I)cc1)(C1CC1)C1CC1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.30
EPHX2 P34913 1/20 0.30
TPMT P51580 1/20 0.30
ACACB O00763 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
SCHEMBL24782522 0.77 HPGD (0.50)
SCHEMBL24899679 0.77 CYP2A6 (0.36)
SCHEMBL14966174 0.76 CA2 (0.44)
SCHEMBL24899727 0.74
SCHEMBL18486590 0.68 HPGD (0.45) EPHX1
SCHEMBL8148549 0.68 SMYD3 (0.39)
SCHEMBL14966208 0.68 GAA (0.44)
SCHEMBL14966930 0.68 GAA (0.44)
SCHEMBL24899757 0.67 HPGD (0.42) TPMT
SCHEMBL24782533 0.67 HDAC1 (0.38)

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
WO-2024010963-A1 HETEROARYL COMPOUNDS AS INHIBITORS OF TYK2/JAK1, COMPOSITION AND APPLICATION THEREOF ACCRO BIOSCIENCE (HK) LIMITED (CN) 2024-01-11 WO disclosed
WO-2023284869-A1 SULFUR/PHOSPHORUS-CONTAINING ARYL COMPOUND AND APPLICATION THEREOF 南京明德新药研发有限公司 2023-01-19 WO disclosed