SCHEMBL305224

SCHEMBL305224

BrCc1cccc(Br)c1Br

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.44
GABRB2 P47870 1/20 0.44
TAAR1 Q96RJ0 3/20 0.39
IDO1 P14902 2/20 0.38
TSHR P16473 3/20 0.36
CYP1A2 P05177 2/20 0.33
CYP2D6 P10635 1/20 0.33
NFKB1 P19838 1/20 0.33
CYP2C19 P33261 1/20 0.33
HSD17B10 Q99714 1/20 0.33
LMNA P02545 2/20 0.32
BLM P54132 1/20 0.32
ALDH1A1 P00352 2/20 0.32
TRPA1 O75762 1/20 0.32
CYP2A13 Q16696 1/20 0.31
CYP1A1 P04798 1/20 0.31
CYP1B1 Q16678 1/20 0.31
KMT2A Q03164 1/20 0.31
PYCR1 P32322 1/20 0.31
GAA P10253 1/20 0.30

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
SCHEMBL29562705 1.00 GABRA1 (0.44) GABRA1GABRB2TAAR1IDO1TSHR
SCHEMBL6275225 0.86 GABRA1 (0.57) GABRA1GABRB2TAAR1IDO1TSHR
SCHEMBL9016954 0.83 GABRA1 (0.48) GABRA1GABRB2TAAR1IDO1TSHR
SCHEMBL4447955 0.80 TAAR1 (0.41) GABRA1GABRB2TAAR1IDO1TSHR
SCHEMBL217088 0.78
SCHEMBL4449960 0.77 GABRA1 (0.48) GABRA1GABRB2TAAR1IDO1TSHR
SCHEMBL629949 0.77 TAAR1 (0.38) GABRA1GABRB2TAAR1IDO1TSHR
SCHEMBL11104057 0.77 GABRA1 (0.48) GABRA1GABRB2TAAR1IDO1TSHR
SCHEMBL4896383 0.77 GABRA1 (0.42) GABRA1GABRB2TAAR1IDO1TSHR
SCHEMBL6042969 0.77 GABRA1 (0.42) GABRA1GABRB2TAAR1IDO1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110475796-B Composition for optical material 三菱瓦斯化学株式会社 2022-02-15 CN disclosed
US-11186673-B2 Composition for use as optical material MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2021-11-30 US disclosed
US-20200223975-A1 COMPOSITION FOR USE AS OPTICAL MATERIAL MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2020-07-16 US disclosed
US-8470860-B2 Phenyl-sulfamates as aromatase inhibitors STERIX LIMITED (GB) 2013-06-25 US disclosed
EP-1966166-B1 1,2,4-TRIAZOL-l-YL BISPHENYL DERIVATIVES FOR USE IN THE TREATMENT OF ENDOCRINE-DEPENDENT TUMOURS STERIX LTD (GB) 2013-01-23 EP disclosed
US-8093279-B2 Compound STERIX LIMITED (GB) 2012-01-10 US disclosed
US-8022224-B2 1,2,4-triazol-1-yl bisphenyl derivatives for use in the treatment of endocrine-dependent tumors STERIX LIMITED (GB) 2011-09-20 US disclosed
US-7922934-B2 s-Indacene and indeno[5,6-d][1,3]dioxol-derivatives and use thereof as components of liquid-crystal mixtures MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2011-04-12 US disclosed
US-20110021586-A1 PHENYL-SULFAMATES AS AROMATASE INHIBITORS STERIX, LIMITED (GB) 2011-01-27 US disclosed
US-7763642-B2 Phenyl-sulfamates as aromatase inhibitors STERIX LTD. (GB) 2010-07-27 US disclosed
EP-0401296-B1 RIGID-ROD POLYMERS MAXDEM INC (US) 1998-04-01 EP disclosed
US-5659005-A Rigid-rod polymers MAXDEM INCORPORATED (US) 1997-08-19 US disclosed
US-5565543-A Rigid-rod polymers MAXDEM INCORPORATED (US) 1996-10-15 US disclosed
US-5227457-A Rigid-rod polymers MAXDEM INCORPORATED (US) 1993-07-13 US disclosed
EP-0489085-A4 RIGID-ROD POLYMERS MAXDEM INC (US) 1992-08-05 EP disclosed
EP-0489085-A1 RIGID-ROD POLYMERS MAXDEM INCORPORATED (US) 1992-06-10 EP disclosed
EP-0401296-A4 RIGID-ROD POLYMERS MAXDEM INC (US) 1992-03-18 EP disclosed
WO-1991002764-A1 RIGID-ROD POLYMERS MAXDEM INCORPORATED (US) 1991-03-07 WO disclosed
EP-0401296-A1 RIGID-ROD POLYMERS MAXDEM INCORPORATED (US) 1990-12-12 EP disclosed
WO-1989007617-A1 RIGID-ROD POLYMERS MAXDEM INCORPORATED (US) 1989-08-24 WO 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-20110021586-A1 PHENYL-SULFAMATES AS AROMATASE INHIBITORS CYP19A1, CYP17A1, CYP21A2 GABRA1 1488/4885GABRB2 889/4885TAAR1 3099/4885

“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.