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Sugi Predict / Compounds / Tribenzoin

Tribenzoin

Tribenzoin

SCHEMBL1785543

O=C(OCC(COC(=O)c1ccccc1)(COC(=O)c1ccccc1)COC(=O)c1ccccc1)c1ccccc1.O=C(OCC(COC(=O)c1ccccc1)OC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.72

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.72
▸ HIF1A Q16665 1/20 0.72
▸ ALDH1A1 P00352 2/20 0.56
▸ PTPN1 P18031 2/20 0.53
▸ SERPINE1 P05121 1/20 0.51
▸ PRKCA P17252 1/20 0.49
▸ ADRB2 P07550 2/20 0.48
▸ ADRB1 P08588 2/20 0.48
▸ ADRB3 P13945 2/20 0.48
▸ TDP1 Q9NUW8 3/20 0.46
▸ TSHR P16473 2/20 0.46
▸ TP53 P04637 1/20 0.46
▸ PTPN2 P17706 1/20 0.46
▸ PTPN11 Q06124 1/20 0.46
▸ KMT2A Q03164 3/20 0.45
▸ SLC6A3 Q01959 2/20 0.45
▸ SLC6A2 P23975 1/20 0.45
▸ HTR1A P08908 1/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ SCN1A P35498 1/20 0.44

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
Tribenzoin SCHEMBL28609 0.90 ALDH1A1 (0.67) MAPK1HIF1AALDH1A1PTPN1SERPINE1
SCHEMBL13599580 0.85 ALDH1A1 (0.61) MAPK1HIF1AALDH1A1PTPN1SERPINE1
SCHEMBL27620 0.85 MAPK1 (1.00) MAPK1HIF1AALDH1A1ADRB2ADRB1
SCHEMBL29964300 0.82 ALDH1A1 (0.61) MAPK1HIF1AALDH1A1PTPN1SERPINE1
SCHEMBL7292206 0.82 ALDH1A1 (0.61) MAPK1HIF1AALDH1A1PTPN1SERPINE1
SCHEMBL3181495 0.82 ALDH1A1 (0.61) MAPK1HIF1AALDH1A1PTPN1SERPINE1
SCHEMBL13809664 0.81 PTPN1 (0.56) MAPK1HIF1AALDH1A1PTPN1SERPINE1
SCHEMBL13809630 0.81 TSHR (0.59) ALDH1A1PTPN1SERPINE1PRKCAADRB2
SCHEMBL6881909 0.81 ALDH1A1 (0.56) MAPK1HIF1AALDH1A1PTPN1SERPINE1
SCHEMBL13809680 0.81 PTPN1 (0.56) MAPK1HIF1AALDH1A1PTPN1SERPINE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3486263-A2 SELF-LIMITING CATALYST COMPOSITION WITH NO SILANE W.R. Grace & CO. - CONN. (US) 2019-05-22 — — EP disclosed
EP-2185600-B1 SELF-LIMITING CATALYST COMPOSITION WITH NO SILANE GRACE W R & CO (US) 2018-10-31 — — EP disclosed
US-9796796-B2 Self-limiting catalyst composition with No silane W. R. GRACE & CO.-CONN. (US) 2017-10-24 — — US disclosed
US-20110124491-A1 Self-Limiting Catalyst Composition with No Silane W. R. GRACE & CO.-CONN. 2011-05-26 — — US disclosed
EP-2185600-A1 SELF-LIMITING CATALYST COMPOSITION WITH NO SILANE Dow Global Technologies Inc. (US) 2010-05-19 — — EP disclosed
WO-2009029447-A1 SELF-LIMITING CATALYST COMPOSITION WITH NO SILANE DOW GLOBAL TECHNOLOGIES INC. (US) 2009-03-05 — — WO disclosed