SCHEMBL6274433

SCHEMBL6274433

Oc1ccc2ccccc2c1SS

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.70
PAK1 Q13153 1/20 0.70
PTPN22 Q9Y2R2 1/20 0.54
POLB P06746 1/20 0.50
HSD17B10 Q99714 3/20 0.48
CYP1A2 P05177 2/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
MAPT P10636 4/20 0.46
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 3/20 0.46
GAA P10253 3/20 0.46
TAAR1 Q96RJ0 1/20 0.46
ERN1 O75460 1/20 0.46
TDP1 Q9NUW8 3/20 0.44
CYP2A6 P11509 1/20 0.44
TSHR P16473 1/20 0.44
IDO1 P14902 1/20 0.42
GLA P06280 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL753620 0.83 USP2 (0.76) USP2PAK1PTPN22POLBHSD17B10
SCHEMBL29354769 0.83 USP2 (1.00) USP2PAK1PTPN22POLBHSD17B10
SCHEMBL4907161 0.83 USP2 (1.00) USP2PAK1PTPN22POLBHSD17B10
SCHEMBL11181173 0.79 USP2 (0.84) USP2PAK1PTPN22POLBHSD17B10
SCHEMBL11660677 0.79 USP2 (0.70) USP2PAK1PTPN22POLBHSD17B10
SCHEMBL28099033 0.75 USP2 (0.63) USP2PAK1PTPN22POLBHSD17B10
SCHEMBL26856124 0.75 USP2 (0.63) USP2PAK1PTPN22POLBHSD17B10
SCHEMBL14762776 0.74 USP2 (0.58) USP2PAK1PTPN22POLBHSD17B10
SCHEMBL20812358 0.73 USP2 (0.79) USP2PAK1PTPN22POLBHSD17B10
SCHEMBL7192775 0.73 USP2 (0.61) USP2PAK1PTPN22POLBHSD17B10

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
CN-118063832-A Non-stick type yoghurt packaging composite material and preparation method thereof 安徽紫金新材料科技股份有限公司 2024-05-24 CN claimed
CN-118063832-A Non-stick type yoghurt packaging composite material and preparation method thereof 安徽紫金新材料科技股份有限公司 2024-05-24 CN disclosed
WO-2005021493-A2 A METHOD OF ISOLATING A THIOL UNIVERSITY OF CAPE TOWN (ZA) 2005-03-10 WO disclosed