SCHEMBL2853873

SCHEMBL2853873

CC(C)(C)c1ccc(C(=O)C(=O)c2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.64
SRD5A2 P31213 1/20 0.61
CES2 O00748 2/20 0.58
CES1 P23141 2/20 0.58
ALDH1A1 P00352 3/20 0.55
MEN1 O00255 2/20 0.55
HTT P42858 2/20 0.55
KMT2A Q03164 2/20 0.55
MAPT P10636 2/20 0.55
RAB9A P51151 2/20 0.55
HIF1A Q16665 1/20 0.55
NPC1 O15118 1/20 0.55
POLB P06746 1/20 0.55
RARB P10826 1/20 0.55
RARG P13631 1/20 0.55
SIRT1 Q96EB6 1/20 0.53
LMNA P02545 2/20 0.52
TYR P14679 1/20 0.52
HDAC3 O15379 1/20 0.52
HDAC11 Q96DB2 1/20 0.52

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
SCHEMBL14947050 0.91 CES2 (0.65) HDAC1SRD5A2CES2CES1ALDH1A1
Water SCHEMBL8945938 0.89 CES2 (0.62) HDAC1SRD5A2CES2CES1ALDH1A1
SCHEMBL4164594 0.88 SRD5A2 (0.61) HDAC1SRD5A2CES2CES1ALDH1A1
SCHEMBL3630235 0.88 HDAC1 (0.57) HDAC1SRD5A2CES2CES1ALDH1A1
SCHEMBL17191457 0.87 RARB (0.76) HDAC1SRD5A2CES2CES1ALDH1A1
SCHEMBL4190159 0.87 KCNK9 (0.56) HDAC1SRD5A2CES2CES1ALDH1A1
SCHEMBL5197425 0.87 KIF11 (0.55) HDAC1SRD5A2CES2CES1ALDH1A1
SCHEMBL22685621 0.86 HDAC1 (0.55) HDAC1SRD5A2CES2CES1ALDH1A1
SCHEMBL11583494 0.86 HDAC1 (0.55) HDAC1SRD5A2ALDH1A1MEN1HTT
SCHEMBL4214148 0.86 HDAC1 (0.55) HDAC1SRD5A2CES2CES1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260107628-A1 SYNTHESIS METHOD FOR HEXAPHENYLBENZENE-BASED ORGANIC SMALL MOLECULES AND APPLICATION IN ELECTROLUMINESCENT DEVICES TIANJIN UNIVERSITY (CN) 2026-04-16 US claimed
CN-119143591-A Benzyl benzoyl or fluoro alkane substituted phenol compound and synthetic method and application thereof 河北中医药大学 2024-12-17 CN claimed
US-20260107628-A1 SYNTHESIS METHOD FOR HEXAPHENYLBENZENE-BASED ORGANIC SMALL MOLECULES AND APPLICATION IN ELECTROLUMINESCENT DEVICES TIANJIN UNIVERSITY (CN) 2026-04-16 US disclosed
CN-116332967-B Electroluminescent material and preparation method and application thereof 湖南航天三丰科工有限公司 2025-06-17 CN disclosed
CN-119462562-A Dual-emission heat-activated delayed fluorescent material and preparation method and application thereof 内蒙古大学 2025-02-18 CN disclosed
CN-119143591-A Benzyl benzoyl or fluoro alkane substituted phenol compound and synthetic method and application thereof 河北中医药大学 2024-12-17 CN disclosed
US-7816520-B2 Such as 1,4-Bis[5,6-(4,4'-dihydroxy)-diphenyl-1,2,4-triazin-3-yl]benzene; cosmetics for human skin, hair PIERRE FABRE DERMO-COSMETIQUE (FR) 2010-10-19 US disclosed
US-7816520-B2 Such as 1,4-Bis[5,6-(4,4'-dihydroxy)-diphenyl-1,2,4-triazin-3-yl]benzene; cosmetics for human skin, hair PIERRE FABRE DERMO-COSMETIQUE (FR) 2010-10-19 US disclosed
US-7816520-B2 Such as 1,4-Bis[5,6-(4,4'-dihydroxy)-diphenyl-1,2,4-triazin-3-yl]benzene; cosmetics for human skin, hair PIERRE FABRE DERMO-COSMETIQUE (FR) 2010-10-19 US disclosed
EP-1753747-B1 5,6-DIPHENYL-1,2,4-TRIAZINIC DIMERIC DERIVATIVES AND THE USE THEREOF IN THE FORM OF SUN-PROTECTIVE AGENTS FABRE PIERRE DERMO COSMETIQUE (FR) 2010-01-13 EP disclosed
EP-1753747-B1 5,6-DIPHENYL-1,2,4-TRIAZINIC DIMERIC DERIVATIVES AND THE USE THEREOF IN THE FORM OF SUN-PROTECTIVE AGENTS FABRE PIERRE DERMO COSMETIQUE (FR) 2010-01-13 EP disclosed
US-20080267892-A1 Such as 1,4-Bis[5,6-(4,4'-dihydroxy)-diphenyl-1,2,4-triazin-3-yl]benzene; cosmetics for human skin, hair PIERRE FABRE DERMO-COSMETIQUE (FR) 2008-10-30 US disclosed
US-20080267892-A1 Such as 1,4-Bis[5,6-(4,4'-dihydroxy)-diphenyl-1,2,4-triazin-3-yl]benzene; cosmetics for human skin, hair PIERRE FABRE DERMO-COSMETIQUE (FR) 2008-10-30 US disclosed
US-20080267892-A1 Such as 1,4-Bis[5,6-(4,4'-dihydroxy)-diphenyl-1,2,4-triazin-3-yl]benzene; cosmetics for human skin, hair PIERRE FABRE DERMO-COSMETIQUE (FR) 2008-10-30 US disclosed
EP-1753747-A1 5,6-DIPHENYL-1,2,4-TRIAZINIC DIMERIC DERIVATIVES AND THE USE THEREOF IN THE FORM OF SUN-PROTECTIVE AGENTS Pierre Fabre Dermo-Cosmetique (FR) 2007-02-21 EP disclosed
WO-2005121128-A1 5,6-DIPHENYL-1,2,4-TRIAZINIC DIMERIC DERIVATIVES AND THE USE THEREOF IN THE FORM OF SUN-PROTECTIVE AGENTS PIERRE FABRE DERMO-COSMETIQUE (FR) 2005-12-22 WO disclosed
US-4287367-A Manufacture of symmetrical or unsymmetrical monoacetals of aromatic 1,2-diketones BASF AKTIENGESELLSCHAFT (DE) 1981-09-01 US disclosed
US-4144156-A Manufacture of unsymmetric monoacetals of aromatic 1,2-diketones employable as photoiniatiators BASF AKTIENGESELLSCHAFT (DE) 1979-03-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20260107628-A1 SYNTHESIS METHOD FOR HEXAPHENYLBENZENE-BASED ORGANIC SMALL MOLECULES AND APPLICATION IN ELECTROLUMINESCENT DEVICES TYR, DDT, DDB1 HDAC1 3112/4885SRD5A2 3206/4885CES2 894/4885
US-20080267892-A1 Such as 1,4-Bis[5,6-(4,4'-dihydroxy)-diphenyl-1,2,4-triazin-3-yl]benzene; cosmetics for human skin, hair TYR, H1-0, TELO2 HDAC1 1061/4885SRD5A2 925/4885CES2 932/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.