SCHEMBL5842467

SCHEMBL5842467

O=C(C(c1ccccc1O)c1ccccc1O)C(c1ccccc1O)c1ccccc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.52
GABRB2 P47870 1/20 0.52
TSHR P16473 2/20 0.46
HPGD P15428 5/20 0.43
KDM4E B2RXH2 5/20 0.43
ALDH1A1 P00352 4/20 0.43
CA12 O43570 3/20 0.43
CA2 P00918 3/20 0.43
CA14 Q9ULX7 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
CA4 P22748 2/20 0.43
MAPT P10636 2/20 0.43
HSD17B10 Q99714 2/20 0.43
POLB P06746 2/20 0.43
HIF1A Q16665 2/20 0.43
NPC1 O15118 1/20 0.43
GMNN O75496 1/20 0.43
EGFR P00533 1/20 0.43
LMNA P02545 1/20 0.43
FYN P06241 1/20 0.43

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
SCHEMBL27817032 0.88 GABRA1 (0.42) GABRA1GABRB2TSHRHPGDKDM4E
SCHEMBL8983937 0.87 MEN1 (0.50) GABRA1GABRB2TSHRHPGDKDM4E
SCHEMBL3360155 0.83 GABRA1 (0.50) GABRA1GABRB2TSHRHPGDKDM4E
SCHEMBL1161818 0.81 GABRA1 (0.48) GABRA1GABRB2TSHRHPGDKDM4E
Ethylene SCHEMBL11785588 0.78 GABRA1 (0.45) GABRA1GABRB2TSHRHPGDKDM4E
SCHEMBL11363822 0.78 MEN1 (0.50) GABRA1GABRB2TSHRHPGDPOLB
SCHEMBL11751568 0.76 GABRA1 (0.60) GABRA1GABRB2TSHRHPGDKDM4E
SCHEMBL28373721 0.75 GABRA1 (0.58) GABRA1GABRB2TSHRHPGDKDM4E
Ethylenediamine SCHEMBL544736 0.74 TSHR (0.42) GABRA1GABRB2TSHRHPGDKDM4E
SCHEMBL6635096 0.74 MEN1 (0.47) GABRA1GABRB2TSHRHPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022041617-A1 DIPHOSPHITE, PREPARATION METHOD THEREFOR AND USE THEREOF 中国海洋石油集团有限公司 2022-03-03 WO disclosed
CN-112010906-B Bisphosphite and preparation method and application thereof 中国海洋石油集团有限公司 2021-09-28 CN disclosed
CN-112010906-A Bisphosphite and preparation method and application thereof 中国海洋石油集团有限公司 2020-12-01 CN disclosed
US-6984716-B2 Phosphorus-containing compound CHANG CHUN PLASTICS CO., LTD. (TW) 2006-01-10 US disclosed
US-20040077825-A1 Phosphorus-containing compound CHANG CHUN PLASTICS CO., LTD. (TW) 2004-04-22 US disclosed