SCHEMBL24313902

SCHEMBL24313902

CCC(C)c1ccc(O)c(I)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.62
ALDH1A1 P00352 4/20 0.62
HSD17B10 Q99714 2/20 0.62
USP2 O75604 1/20 0.62
PKM P14618 1/20 0.62
HPGD P15428 1/20 0.62
ALOX15 P16050 1/20 0.62
HDAC4 P56524 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
LMNA P02545 3/20 0.46
HTT P42858 2/20 0.46
MAPT P10636 3/20 0.45
MAPK1 P28482 3/20 0.45
TP53 P04637 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
RORC P51449 1/20 0.43
TSHR P16473 2/20 0.42
FOLH1 Q04609 2/20 0.39

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
SCHEMBL683547 0.82 HSD17B10 (0.69) GAAALDH1A1HSD17B10USP2PKM
SCHEMBL487428 0.80 GAA (0.67) GAAALDH1A1HSD17B10USP2PKM
SCHEMBL28161630 0.80 GAA (0.67) GAAALDH1A1HSD17B10USP2PKM
SCHEMBL11112214 0.79 ESR1 (0.46) GAAALDH1A1HSD17B10USP2PKM
SCHEMBL25699191 0.79 ALDH1A1 (0.46) GAAALDH1A1HSD17B10USP2PKM
SCHEMBL788149 0.79 ALDH1A1 (0.57) GAAALDH1A1HSD17B10HPGDALOX15
Butane SCHEMBL27803637 0.78 HSD17B10 (0.65) GAAALDH1A1HSD17B10USP2PKM
SCHEMBL97663 0.78 GAA (0.65) GAAALDH1A1HSD17B10USP2PKM
SCHEMBL11961094 0.78 GAA (0.59) GAAALDH1A1HSD17B10USP2PKM
SCHEMBL7541393 0.78 TDP1 (0.47) GAAALDH1A1HSD17B10HPGDALOX15

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11815813-B2 Compound, resin, resist composition and method for producing resist pattern SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-11-14 US disclosed
WO-2022081842-A1 SUBSTITUTED ACYL SULFONAMIDES FOR TREATING CANCER THE BROAD INSTITUTE, INC. (US) 2022-04-21 WO disclosed
WO-2022081807-A1 SUBSTITUTED ACYL SULFONAMIDES FOR TREATING CANCER THE BROAD INSTITUTE, INC. (US) 2022-04-21 WO disclosed