SCHEMBL2854089

SCHEMBL2854089

CCCCCCCCC(Br)CCCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.51
HTR2A P28223 2/20 0.49
CSNK1E P49674 1/20 0.47
SIGMAR1 Q99720 4/20 0.47
CETP P11597 1/20 0.45
ESR1 P03372 2/20 0.43
ADRA2A P08913 2/20 0.43
ADORA3 P0DMS8 2/20 0.43
TACR2 P21452 2/20 0.43
SLC6A2 P23975 2/20 0.43
SLC6A4 P31645 2/20 0.43
SLC6A3 Q01959 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
SHBG P04278 1/20 0.43
TP53 P04637 1/20 0.43
CYP3A4 P08684 1/20 0.43
HSPD1 P10809 1/20 0.43
ADRB3 P13945 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
SCHEMBL4749538 1.00 KCNH2 (0.51) KCNH2HTR2ACSNK1ESIGMAR1CETP
SCHEMBL7062802 0.98 SIGMAR1 (0.49) KCNH2HTR2ACSNK1ESIGMAR1CETP
SCHEMBL2790330 0.93 KCNH2 (0.46) KCNH2HTR2ASIGMAR1ADRA2ASLC6A2
SCHEMBL11785905 0.89 SIGMAR1 (0.50) KCNH2HTR2ASIGMAR1
SCHEMBL18093956 0.89 SIGMAR1 (0.49) KCNH2SIGMAR1ADRA2ASLC6A2SLC6A4
SCHEMBL3322171 0.84 KCNH2 (0.53) KCNH2HTR2ACSNK1ESIGMAR1CETP
SCHEMBL11785493 0.84 SIGMAR1 (0.47) KCNH2SIGMAR1
SCHEMBL28523845 0.84 CSNK1E (0.57) CSNK1ETP53CNR2
SCHEMBL27952343 0.84 KCNH2 (0.53) KCNH2HTR2ACSNK1ESIGMAR1CETP
SCHEMBL27984757 0.84 KCNH2 (0.53) KCNH2HTR2ACSNK1ESIGMAR1CETP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3805337-B1 INK COMPOSITIONS AND QUANTUM DOT POLYMER COMPOSITE PATTERN PREPARED FROM THE SAME SAMSUNG DISPLAY CO LTD (KR) 2023-08-09 EP disclosed
US-11248139-B2 Ink compositions and quantum dot polymer composite pattern prepared from the same SAMSUNG DISPLAY CO., LTD. (KR) 2022-02-15 US disclosed
EP-3805337-A1 INK COMPOSITIONS AND QUANTUM DOT POLYMER COMPOSITE PATTERN PREPARED FROM THE SAME Samsung Display Co., Ltd. (KR) 2021-04-14 EP disclosed
US-20210102084-A1 INK COMPOSITIONS AND QUANTUM DOT POLYMER COMPOSITE PATTERN PREPARED FROM THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2021-04-08 US disclosed
WO-2016193748-A1 COMPOSITION THE UNIVERSITY OF BIRMINGHAM (GB) 2016-12-08 WO 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
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-6235871-B1 Synthesis of oligoarylamines, and uses and reagents related thereto MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2001-05-22 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 (1 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-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 KCNH2 216/4885HTR2A 1197/4885CSNK1E 4025/4885

“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.