SCHEMBL3235017

SCHEMBL3235017

BrC1=Cc2ccccc2ON1

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.31
NISCH Q9Y2I1 1/20 0.31
MEN1 O00255 1/20 0.31
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
UBE2N P61088 1/20 0.31
KMT2A Q03164 1/20 0.31
ALOX5 P09917 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
SCHEMBL28348331 0.84 CA12 (0.30)
SCHEMBL3074957 0.76 ALOX5 (0.37) NISCHMEN1TP53MAPTTSHR
SCHEMBL29664451 0.74 NISCH (0.32) NISCHMEN1TP53MAPTTSHR
SCHEMBL1491185 0.73 ALOX5 (0.32) NISCHMEN1TP53MAPTTSHR
SCHEMBL1871103 0.73 MEN1 (0.34) NISCHMEN1TP53MAPTTSHR
SCHEMBL5181282 0.73 TSHR (0.34) NISCHMEN1TP53MAPTTSHR
SCHEMBL2075819 0.73 ALOX5 (0.35) NISCHMEN1TP53MAPTTSHR
SCHEMBL1493437 0.73 MEN1 (0.34) NISCHMEN1TP53MAPTTSHR
SCHEMBL30417860 0.73 AHR (0.33) AHRNISCHMEN1TP53MAPT
SCHEMBL15284929 0.73 PTGS1 (0.33) NISCHMEN1TP53MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117586198-B Bromobenzoxazines method for synthesizing compound 南开大学 2024-10-25 CN claimed
CN-117586198-A Synthesis method of bromobenzoxazine compound 南开大学 2024-02-23 CN claimed
CN-117586198-B Bromobenzoxazines method for synthesizing compound 南开大学 2024-10-25 CN disclosed
CN-117586198-B Bromobenzoxazines method for synthesizing compound 南开大学 2024-10-25 CN disclosed
CN-117586198-A Synthesis method of bromobenzoxazine compound 南开大学 2024-02-23 CN disclosed
CN-117586198-A Synthesis method of bromobenzoxazine compound 南开大学 2024-02-23 CN disclosed
CN-117586198-A Synthesis method of bromobenzoxazine compound 南开大学 2024-02-23 CN disclosed
CN-110770213-B Sulfurized benzoxazines for use in the synthesis of polybenzoxazines 米其林集团总公司 2023-04-11 CN disclosed
CN-110770314-B Metal or metallized reinforcement having a surface coated with a cured polybenzoxazine 米其林集团总公司 2021-10-01 CN disclosed
CN-110770213-A Sulfurized benzoxazines for use in the synthesis of polybenzoxazines 米其林集团总公司 2020-02-07 CN disclosed
CN-110770314-A Metal or metallized reinforcement having a surface coated with a cured polybenzoxazine 米其林集团总公司 2020-02-07 CN disclosed
WO-2014078813-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES IRM LLC (BM) 2014-05-22 WO disclosed
US-20110206661-A1 TRIMETHOXYPHENYL INHIBITORS OF TYROSINE KINASE AUSPEX PHARMACEUTICALS, INC. (US) 2011-08-25 US disclosed
EP-1458392-B9 ACRIDONES AS INHIBITORS OF IMPDH ENZYME BRISTOL MYERS SQUIBB CO (US) 2010-07-28 EP disclosed
EP-1458392-B1 ACRIDONES AS INHIBITORS OF IMPDH ENZYME BRISTOL MYERS SQUIBB CO (US) 2009-09-02 EP disclosed
US-7312209-B2 Acridone inhibitors of IMPDH enzyme BRISTOL-MYERS SQUIBB COMPANY (US) 2007-12-25 US disclosed
EP-1458392-A4 ACRIDONE INHIBITORS OF IMPDH ENZYME BRISTOL MYERS SQUIBB CO (US) 2005-06-08 EP disclosed
EP-1458392-A2 ACRIDONE INHIBITORS OF IMPDH ENZYME Bristol-Myers Squibb Company (US) 2004-09-22 EP disclosed
US-20040053955-A1 Acridone inhibitors of IMPDH enzyme BRISTOL-MYERS SQUIBB COMPANY 2004-03-18 US disclosed
WO-2003059269-A2 ACRIDONE INHIBITORS OF IMPDH ENZYME BRISTOL-MYERS SQUIBB COMPANY (US) 2003-07-24 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 (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-20110206661-A1 TRIMETHOXYPHENYL INHIBITORS OF TYROSINE KINASE ABL1, LCK, SRC AHR 1996/4885NISCH 3896/4885MEN1 3423/4885
US-20040053955-A1 Acridone inhibitors of IMPDH enzyme IMPDH2, IMPDH1, XDH AHR 619/4885NISCH 1608/4885MEN1 4579/4885

“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.