SCHEMBL6005895

SCHEMBL6005895

O=C1c2ccccc2C(=O)N1c1cc(O)ccc1O

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 8/20 0.62
ESR2 Q92731 6/20 0.62
NR1H3 Q13133 6/20 0.50
TYMS P04818 1/20 0.50
HSP90AA1 P07900 1/20 0.46
NR1H2 P55055 1/20 0.46
ANPEP P15144 1/20 0.46
DPP4 P27487 1/20 0.46
PIM3 Q86V86 1/20 0.45
HIPK4 Q8NE63 1/20 0.45
SCN2A Q99250 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL12733162 0.84 ESR1 (0.51) ESR1ESR2NR1H3TYMSNR1H2
SCHEMBL19950447 0.82 CYP3A4 (0.61) ESR1ESR2NR1H3TYMSNR1H2
SCHEMBL8079827 0.82 ESR1 (0.72) ESR1ESR2NR1H3ANPEPDPP4
SCHEMBL30268221 0.81 TYMS (0.72) ESR1ESR2NR1H3TYMSHSP90AA1
SCHEMBL2150841 0.80 MEN1 (0.55) ESR1ESR2NR1H3NR1H2PIM3
SCHEMBL3435311 0.79 CYP3A4 (0.66) ESR1ESR2NR1H3NR1H2MEN1
SCHEMBL17200427 0.77 LMNA (0.50) ESR1ESR2NR1H3TYMSNR1H2
SCHEMBL23133322 0.76 TYMS (0.43) ESR1ESR2NR1H3TYMSHSP90AA1
SCHEMBL8585931 0.75 POLB (0.68) ESR1ESR2NR1H3ANPEPDPP4
SCHEMBL27250012 0.74 TYMS (0.44) ESR1ESR2NR1H3TYMSHSP90AA1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117567411-A Polyimide dianhydride monomer capable of realizing bidirectional polymerization and synthesis method thereof 仪征市海帆化工有限公司 2024-02-20 CN claimed
CN-117247367-A Novel polyimide dianhydride monomer and synthesis method thereof 邹从伟 2023-12-19 CN claimed
CN-117567411-A Polyimide dianhydride monomer capable of realizing bidirectional polymerization and synthesis method thereof 仪征市海帆化工有限公司 2024-02-20 CN disclosed
CN-117567411-A Polyimide dianhydride monomer capable of realizing bidirectional polymerization and synthesis method thereof 仪征市海帆化工有限公司 2024-02-20 CN disclosed
CN-117247367-A Novel polyimide dianhydride monomer and synthesis method thereof 邹从伟 2023-12-19 CN disclosed
CN-117247367-A Novel polyimide dianhydride monomer and synthesis method thereof 邹从伟 2023-12-19 CN disclosed
EP-1682555-A1 MACROCYCLIC KINASE INHIBITORS ABBOTT LABORATORIES (US) 2006-07-26 EP disclosed
US-20050215556-A1 Macrocyclic kinase inhibitors ABBVIE INC. 2005-09-29 US disclosed
WO-2005047294-A1 MACROCYCLIC KINASE INHIBITORS ABBOTT LABORATORIES (US) 2005-05-26 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-20050215556-A1 Macrocyclic kinase inhibitors MAP3K20, MAP3K19, MAP3K7 ESR1 3362/4885ESR2 2051/4885NR1H3 2596/4885

“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.