SCHEMBL2016123

SCHEMBL2016123

O=[PH](OCc1ccc(Br)cc1)OCc1ccc(Br)cc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 4/20 0.52
HTR2A P28223 1/20 0.43
TAAR1 Q96RJ0 1/20 0.43
APP P05067 1/20 0.42
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
MAOB P27338 5/20 0.41
KMT2A Q03164 2/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
KDM4E B2RXH2 1/20 0.41
FFAR1 O14842 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40
MAOA P21397 2/20 0.39
MEN1 O00255 1/20 0.38

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
SCHEMBL5051394 0.90 IDO1 (0.44) IDO1HTR2ATAAR1APPRXRA
SCHEMBL8038501 0.88 IDO1 (0.45) IDO1HTR2ATAAR1APPRXRA
SCHEMBL4938371 0.83 IDO1 (0.48) IDO1HTR2ATAAR1APPRXRA
SCHEMBL9849327 0.82 TRPA1 (0.39) IDO1CA2CA9
SCHEMBL742829 0.79 ALDH1A1 (0.46) APPMAOBKMT2ACA2CA9
SCHEMBL8855401 0.79 IDO1 (0.50) IDO1TAAR1APPKMT2ACA2
SCHEMBL4408254 0.78 TAAR1 (0.50) IDO1HTR2ATAAR1MAOBKMT2A
SCHEMBL4412388 0.77 IDO1 (0.50) IDO1MAOB
SCHEMBL6020749 0.77 CA2 (0.32) CA2CA9
SCHEMBL17061042 0.77 CYP3A4 (0.52) IDO1APPRXRARXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118006052-A Environment-friendly flame-retardant polystyrene composite material and preparation method thereof 连云港传奇阻燃科技有限公司 2024-05-10 CN claimed
CN-110229108-B Styrene-bis-phenanthroimidazole derivative and preparation method and application thereof 广东工业大学 2022-06-14 CN claimed
CN-118006052-A Environment-friendly flame-retardant polystyrene composite material and preparation method thereof 连云港传奇阻燃科技有限公司 2024-05-10 CN disclosed
CN-117980292-A Substituted pyridone compounds for the treatment of orthomyxoviral infections 诺华股份有限公司 2024-05-03 CN disclosed
CN-117279898-A Antibacterial compounds 布莱克史密斯医药公司 2023-12-22 CN disclosed
CN-116041392-A Compound containing phosphate group, preparation method and application thereof 中国科学院长春应用化学研究所 2023-05-02 CN disclosed
CN-110229108-B Styrene-bis-phenanthroimidazole derivative and preparation method and application thereof 广东工业大学 2022-06-14 CN disclosed
CN-109705041-A A kind of phenanthro- glyoxaline compound of triphenylamine substitution-modified by vinyl and preparation method thereof and application as electroluminescent device 广东工业大学 2019-05-03 CN disclosed
CN-107434814-B Modified conjugated polymer and its preparation method and application 中国科学院化学研究所 2019-05-03 CN disclosed
CN-107098818-A Aromatic compound and organic light emitting diode comprising same 郑建鸿 2017-08-29 CN disclosed
US-20120328518-A1 PROSTATE SPECIFIC MEMBRANE ANTIGEN INHIBITORS PIRAMAL IMAGING SA (CH) 2012-12-27 US disclosed
US-20080139778-A1 Resin and article molded therefrom TAKANISHI KEIJIRO 2008-06-12 US disclosed
US-20060287464-A1 Resin and article molded therefrom TORAY INDUSTRIES, INC. (JP) 2006-12-21 US disclosed
EP-1640405-A1 RESIN AND ARTICLE MOLDED THEREFROM TORAY INDUSTRIES, INC. (JP) 2006-03-29 EP disclosed
US-6750313-B2 HIGH REFRACTIVE INDEX AND LOW DISPERSION CHARACTERISTICS; OPTICAL LENSES, FILMS, DISCS; POLYCARBONATE RESIN CONTAINING A PHOSPHONIC ACID GROUP TORAY INDUSTRIES, INC. (JP) 2004-06-15 US disclosed
US-20030157367-A1 Blue light-emitting polymer containing 9, 10-diphenylanthracene moiety and electroluminescent device using the same SK CORPORATION 2003-08-21 US disclosed
WO-2003040255-A1 BLUE LIGHT-EMITTING POLYMER CONTAINING 9,10-DIPHENYLANTHRACENE MOIETY AND ELECTROLUMINESCENT DEVICE USING THE SAME SK CORPORATION (KR) 2003-05-15 WO disclosed
US-20030013836-A1 Resin composition and articles molded therefrom TORAY INDUSTRIES, INC., A CORPORATION OF JAPAN (JP) 2003-01-16 US disclosed
EP-1270646-A1 RESIN COMPOSITION AND ARTICLES MOLDED THEREFROM TORAY INDUSTRIES, INC. (JP) 2003-01-02 EP disclosed
CN-1053793-A Use the disease that benzylphosphonic acid derivatives for treatment is caused by virus HOECHST AG (DE) 1991-08-14 CN 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-20120328518-A1 PROSTATE SPECIFIC MEMBRANE ANTIGEN INHIBITORS KLK3, FOLH1, ACP3 IDO1 4708/4885HTR2A 4716/4885TAAR1 3830/4885

“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.