SCHEMBL1128437

SCHEMBL1128437

CCC(Br)CCCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.46
CHRM2 P08172 1/20 0.46
HTR1A P08908 1/20 0.46
ADRA2A P08913 1/20 0.46
CHRM1 P11229 1/20 0.46
DRD1 P21728 1/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A4 P31645 1/20 0.46
ADRA1A P35348 1/20 0.46
OPRM1 P35372 1/20 0.46
DRD3 P35462 1/20 0.46
SLC6A3 Q01959 1/20 0.46
KCNH2 Q12809 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
MAOA P21397 1/20 0.42
TDP1 Q9NUW8 1/20 0.41

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
Ethylene SCHEMBL27683132 0.96 SIGMAR1 (0.44) SIGMAR1CHRM2HTR1AADRA2ACHRM1
SCHEMBL11785493 0.92 SIGMAR1 (0.47) SIGMAR1KCNH2L3MBTL1MAOA
SCHEMBL29414580 0.90 ALDH1A1 (0.38) SIGMAR1CHRM2ADRA2ACHRM1SLC6A2
SCHEMBL18093956 0.86 SIGMAR1 (0.49) SIGMAR1CHRM2HTR1AADRA2ACHRM1
SCHEMBL2790330 0.86 KCNH2 (0.46) SIGMAR1CHRM2HTR1AADRA2ACHRM1
SCHEMBL7062802 0.85 SIGMAR1 (0.49) SIGMAR1CHRM2HTR1AADRA2ACHRM1
SCHEMBL2854089 0.83 KCNH2 (0.51) SIGMAR1CHRM2ADRA2ACHRM1SLC6A2
SCHEMBL4749538 0.83 KCNH2 (0.51) SIGMAR1CHRM2ADRA2ACHRM1SLC6A2
SCHEMBL2078829 0.81 ESR1 (0.53) SIGMAR1CHRM2HTR1AADRA2ACHRM1
SCHEMBL1678739 0.80 SMN1; SMN2 (0.46) SIGMAR1CHRM2HTR1AADRA2ACHRM1

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 54 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250376622-A1 COPOLYMER, ELECTROLUMINESCENT DEVICE MATERIAL INCLUDING COPOLYMER, AND ELECTROLUMINESCENT DEVICE SAMSUNG ELECTRONICS CO LTD (KR) 2025-12-11 US disclosed
US-12384965-B2 Copolymer, electroluminescent device material including copolymer, and electroluminescent device SAMSUNG ELECTRONICS CO., LTD. (KR) 2025-08-12 US disclosed
US-11917899-B2 Arylamine-fluorene alternating copolymer, electroluminescence device material, and electroluminescence device using the polymer SAMSUNG ELECTRONICS CO., LTD. (KR) 2024-02-27 US disclosed
US-20230212334-A1 POLYMER, ELECTROLUMINESCENCE MATERIAL, ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC DEVICE SAMSUNG ELECTRONICS CO LTD (KR) 2023-07-06 US disclosed
CN-114478569-B Multi-fused ring conjugated small molecule based on thiophene [3,2-b ] pyrrole, and preparation method and application thereof 宁波诺丁汉大学 2023-04-07 CN disclosed
US-20220204673-A1 COPOLYMER, ELECTROLUMINESCENT DEVICE MATERIAL INCLUDING COPOLYMER, AND ELECTROLUMINESCENT DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2022-06-30 US disclosed
CN-112159529-B Supramolecular polymer gel, preparation thereof and application of supramolecular polymer gel in fluorescent recognition of iron ions 陇东学院 2022-05-24 CN disclosed
CN-114478569-A Multi-fused-ring conjugated small molecule based on thiophene [3,2-b ] pyrrole and preparation method and application thereof 宁波诺丁汉大学 2022-05-13 CN disclosed
CN-112175195-B Supramolecular polymer gel, preparation thereof and application of supramolecular polymer gel in fluorescent recognition of iron ions and fluorine ions 陇东学院 2022-02-11 CN disclosed
US-20210288258-A1 ARYLAMINE-FLUORENE ALTERNATING COPOLYMER, ELECTROLUMINESCENCE DEVICE MATERIAL, AND ELECTROLUMINESCENCE DEVICE USING THE POLYMER SAMSUNG ELECTRONICS CO., LTD. (KR) 2021-09-16 US disclosed
US-20090299029-A1 SOLUBLE POLYTHIOPHENE DERIVATIVES INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2009-12-03 US disclosed
WO-2009141288-A2 SWITCHABLE SPECIAL EFFECT SUBSTANCES BASF SE (DE) 2009-11-26 WO disclosed
CN-101492529-A Soluble polythiophene derivative and application thereof in photoelectric component IND TECH RES INST (CN) 2009-07-29 CN disclosed
US-20090171048-A1 Homo- and copolymers prepared from fused phenylenedithiophenes which themselves are prepared by intramolecular cyclization of, e.g., a 2,5-di-2-thiophenylterephthalate; used in organic thin film transistors, organic light-emitting diode, and organic solar cells INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2009-07-02 US disclosed
EP-2075274-A1 Soluble polythiophene derivatives Industrial Technology Research Institute (TW) 2009-07-01 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
WO-2008120839-A1 NOVEL ORGANIC SEMICONDUCTOR COMPOUND, AND ORGANIC THIN FILM TRANSISTOR USING THE SAME GYEONGSANG NATIONAL UNIVERSITY INDUSTRIAL AND ACADEMIC COLLABORATION FOUNDATION (KR) 2008-10-09 WO 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-20050093031-A1 Devices having large organic semiconductor crystals and methods of making the same LUCENT TECHNOLOGIES, INC. (US) 2005-05-05 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 SIGMAR1 2600/4885CHRM2 1015/4885HTR1A 1023/4885

“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.