SCHEMBL29463715

SCHEMBL29463715

COc1ccc(CCl)cc1OCc1ccccc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.52
MAPK1 P28482 2/20 0.52
HSD17B10 Q99714 1/20 0.52
KDM4E B2RXH2 4/20 0.52
LMNA P02545 3/20 0.52
HTT P42858 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
ALDH1A1 P00352 2/20 0.52
KMT2A Q03164 2/20 0.50
ABCB1 P08183 2/20 0.50
NPY1R P25929 1/20 0.50
NPY2R P49146 1/20 0.50
ABCG2 Q9UNQ0 1/20 0.50
BCHE P06276 1/20 0.50
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
BLM P54132 1/20 0.49
SIRT2 Q8IXJ6 1/20 0.48

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
SCHEMBL25253735 1.00 TTR (0.52) TTRMAPK1HSD17B10KDM4ELMNA
SCHEMBL29463780 0.95 TTR (0.56) TTRHSD17B10KDM4ELMNASMN1; SMN2
SCHEMBL25292206 0.95 TTR (0.56) TTRHSD17B10KDM4ELMNASMN1; SMN2
SCHEMBL6672350 0.92 TTR (0.60) TTRMAPK1HSD17B10KDM4ELMNA
SCHEMBL11093699 0.90 TTR (0.59) TTRMAPK1HSD17B10KDM4ELMNA
Phosphine SCHEMBL4434544 0.90 TTR (0.59) TTRMAPK1HSD17B10KDM4ELMNA
SCHEMBL30493137 0.88 MEN1 (0.56) MAPK1HSD17B10KDM4ELMNAHTT
SCHEMBL25248791 0.88 MEN1 (0.56) MAPK1HSD17B10KDM4ELMNAHTT
SCHEMBL5387584 0.86 TTR (0.65) TTRHSD17B10KDM4ELMNASMN1; SMN2
SCHEMBL2074825 0.82 SLC2A1 (0.52) TTRMAPK1HSD17B10KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119390572-A Dichloroacetic acid coupling diphenyl ethane compound, preparation method and application thereof 上海华理生物医药股份有限公司 2025-02-07 CN disclosed
CN-114230466-B Dichloroacetic acid coupling diphenyl ethane compound, preparation method and application thereof 上海华理生物医药股份有限公司 2024-10-15 CN disclosed
WO-2023123695-A1 DICHLOROACETIC-ACID-COUPLED DIPHENYLETHANE COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海华理生物医药股份有限公司 2023-07-06 WO disclosed
CN-114230466-A Dichloroacetic acid coupled diphenylethane compound, preparation method and application thereof 上海华理生物医药股份有限公司 2022-03-25 CN disclosed