SCHEMBL30445249

SCHEMBL30445249

COc1ccc([I+]c2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.53
ALDH1A1 P00352 4/20 0.51
MAPK1 P28482 2/20 0.51
LMNA P02545 1/20 0.51
ALOX15 P16050 1/20 0.51
APEX1 P27695 1/20 0.51
RECQL P46063 1/20 0.51
HSD17B10 Q99714 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA9 Q16790 2/20 0.46
CA12 O43570 1/20 0.46
CA7 P43166 1/20 0.46
CA14 Q9ULX7 1/20 0.46
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
MEN1 O00255 1/20 0.45
EPHX2 P34913 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL78643 0.87 MAPT (0.64) MAPTALDH1A1MAPK1LMNAALOX15
SCHEMBL3665016 0.87 MAPT (0.64) MAPTALDH1A1MAPK1LMNAALOX15
SCHEMBL7903612 0.85 HSD11B1 (0.48) MAPTALDH1A1MAPK1LMNAALOX15
SCHEMBL29566113 0.85 MAPT (0.42) MAPTALDH1A1MAPK1LMNAALOX15
Fluoride SCHEMBL31538992 0.84 MAPT (0.62) MAPTALDH1A1MAPK1LMNAALOX15
SCHEMBL12762156 0.84 TSHR (0.52) MAPTALDH1A1MAPK1LMNAALOX15
SCHEMBL144129 0.84 CA1 (0.65) MAPTALDH1A1MAPK1RECQLTDP1
SCHEMBL70734 0.84 TSHR (0.52) MAPTALDH1A1MAPK1LMNAALOX15
Fluoride Ion SCHEMBL245850 0.82 CA1 (0.61) MAPTALDH1A1MAPK1RECQLTDP1
Iodide SCHEMBL10788331 0.82 CA1 (0.61) MAPTALDH1A1MAPK1RECQLTDP1

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
CN-116324620-A Lithographic printing plate precursor 爱克发胶印有限公司 2023-06-23 CN disclosed