SCHEMBL653872

SCHEMBL653872

BrC(Br)C(c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
TRPA1 O75762 1/20 0.46
DPP4 P27487 2/20 0.43
F2 P00734 1/20 0.43
TSHR P16473 1/20 0.43
LMNA P02545 3/20 0.40
TAAR1 Q96RJ0 2/20 0.39
HTR2A P28223 1/20 0.39
CYP2D6 P10635 1/20 0.38
SRC P12931 1/20 0.38
HRH1 P35367 1/20 0.36
MTOR P42345 1/20 0.36
RAB9A P51151 1/20 0.36
GRM7 Q14831 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL5968382 0.80 CES2 (0.41) CES2CES1TRPA1DPP4F2
SCHEMBL448348 0.79 DPP4 (0.53) CES2CES1DPP4F2TSHR
SCHEMBL4808940 0.78 CES2 (0.39) CES2CES1TRPA1DPP4F2
SCHEMBL28346122 0.76 DPP4 (0.50) CES2CES1DPP4F2TSHR
SCHEMBL7868855 0.75 CES2 (0.46) CES2CES1TRPA1DPP4F2
SCHEMBL13590015 0.73 CES2 (0.50) CES2CES1TRPA1DPP4F2
SCHEMBL4456759 0.73 CES2 (0.50) CES2CES1TRPA1DPP4F2
SCHEMBL150507 0.73
SCHEMBL67123 0.73 CES2 (0.50) CES2CES1TRPA1DPP4F2
SCHEMBL11212730 0.73 CES2 (0.44) CES2CES1TRPA1DPP4F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113200913-B Light-activated type I photosensitizer and preparation method and application thereof 华南理工大学 2022-10-21 CN claimed
CN-115011007-A High-flame-retardance low-smoke heat-insulation heat-preservation rubber and plastic product and preparation method thereof 华能中天节能科技集团有限责任公司 2022-09-06 CN claimed
US-7977421-B2 Brominated diphenyl ethane mixtures and resin compositions including the same CHEIL INDUSTRIES INC. (KR) 2011-07-12 US claimed
US-20100029828-A1 Brominated Diphenyl Ethane Mixtures and Resin Compositions Including the Same CHEIL INDUSTRIES INC. (KR) 2010-02-04 US claimed
US-7059382-B2 Method of incorporating brominated compounds as additives to expanded polystyrene molded patterns for use in lost foam aluminum casting GENERAL MOTORS CORPORATION (US) 2006-06-13 US claimed
US-20050043464-A1 Method of incorporating brominated compounds as additives to expanded polystyrene molded patterns for use in lost foam aluminum casting GM Global Technology Operations LLC 2005-02-24 US claimed
EP-3527600-B1 ISOCYANATE COMPOSITION AND PRODUCTION METHOD FOR ISOCYANATE POLYMER ASAHI CHEMICAL IND (JP) 2025-07-09 EP disclosed
US-20230114799-A1 ISOCYANATE COMPOSITION AND METHOD FOR PRODUCING ISOCYANATE POLYMER ASAHI KASEI KABUSHIKI KAISHA (JP) 2023-04-13 US disclosed
US-11548975-B2 Isocyanate composition and method for producing isocyanate polymer ASAHI KASEI KABUSHIKI KAISHA (JP) 2023-01-10 US disclosed
CN-115011007-A High-flame-retardance low-smoke heat-insulation heat-preservation rubber and plastic product and preparation method thereof 华能中天节能科技集团有限责任公司 2022-09-06 CN disclosed
CN-109803992-B Isocyanate composition and method for producing isocyanate polymer 旭化成株式会社 2022-05-24 CN disclosed
CN-109843963-B Isocyanate composition, method for producing isocyanate polymer, and isocyanate polymer 旭化成株式会社 2022-05-13 CN disclosed
CN-112647673-B Digital wood grain 3D digital jet printing solid wood floor and manufacturing method thereof 浙江云峰莫干山地板有限公司 2022-03-18 CN disclosed
US-20100029828-A1 Brominated Diphenyl Ethane Mixtures and Resin Compositions Including the Same CHEIL INDUSTRIES INC. (KR) 2010-02-04 US disclosed
US-7059382-B2 Method of incorporating brominated compounds as additives to expanded polystyrene molded patterns for use in lost foam aluminum casting GENERAL MOTORS CORPORATION (US) 2006-06-13 US disclosed
US-20050043464-A1 Method of incorporating brominated compounds as additives to expanded polystyrene molded patterns for use in lost foam aluminum casting GM Global Technology Operations LLC 2005-02-24 US disclosed
US-4887889-A Organopolysiloxanes exhibiting nonlinear response HOECHST CELANESE CORPORATION (US) 1989-12-19 US disclosed
US-4855078-A Organopolysiloxanes exhibiting nonlinear response HOECHST CELANESE CORP. (US) 1989-08-08 US disclosed
US-4807968-A Polymer blends exhibiting nonlinear optical response HOECHST CELANESE CORP. (US) 1989-02-28 US disclosed
US-4801659-A Organopolysiloxanes exhibiting nonlinear optical response HOECHST CELANESE CORP. (US) 1989-01-31 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-11548975-B2 Isocyanate composition and method for producing isocyanate polymer IDH3A, IDH2, IDH3B CES2 974/4885CES1 2463/4885TRPA1 899/4885
US-20230114799-A1 ISOCYANATE COMPOSITION AND METHOD FOR PRODUCING ISOCYANATE POLYMER IDH3A, IDH2, IDH3B CES2 959/4885CES1 2329/4885TRPA1 953/4885

“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.