SCHEMBL653871

SCHEMBL653871

BrCC(Br)(c1ccccc1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 4/20 0.43
TSHR P16473 3/20 0.43
ALDH1A1 P00352 2/20 0.43
TRPA1 O75762 1/20 0.43
TAAR1 Q96RJ0 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
MAPK1 P28482 1/20 0.38
KIF11 P52732 4/20 0.37

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
SCHEMBL16933980 0.85 KIF11 (0.48) TSHRALDH1A1MAPK1KIF11
SCHEMBL8830673 0.79 KCNN4 (0.41) KCNN4TSHRALDH1A1TRPA1TAAR1
SCHEMBL10588674 0.79 KCNN4 (0.41) KCNN4TSHRALDH1A1TRPA1TAAR1
SCHEMBL9146310 0.79 KIF11 (0.46) KCNN4TSHRALDH1A1TRPA1TAAR1
SCHEMBL16933983 0.77 KIF11 (0.37) KCNN4TSHRALDH1A1TRPA1TAAR1
SCHEMBL10477456 0.75 CYP2C19 (0.52) KCNN4TSHRALDH1A1TRPA1TAAR1
SCHEMBL7938667 0.75 TAAR1 (0.46) KCNN4TSHRALDH1A1TRPA1TAAR1
SCHEMBL7747506 0.75 CYP2C19 (0.44) KCNN4TSHRALDH1A1TRPA1TAAR1
SCHEMBL9578236 0.75 KCNN4 (0.39) KCNN4TSHRALDH1A1TRPA1TAAR1
SCHEMBL2281974 0.75 TSHR (0.50) KCNN4TSHRALDH1A1TRPA1TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-20250215260-A1 SILPHENYLENE POLYMERS WACKER CHEMIE AG (DE) 2025-07-03 US 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
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
US-4085153-A Bromination of unreactive olefins with bromine chloride THE DOW CHEMICAL COMPANY (US) 1978-04-18 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 KCNN4 810/4885TSHR 4885/4885ALDH1A1 643/4885
US-20230114799-A1 ISOCYANATE COMPOSITION AND METHOD FOR PRODUCING ISOCYANATE POLYMER IDH3A, IDH2, IDH3B KCNN4 1178/4885TSHR 4885/4885ALDH1A1 666/4885

“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.