SCHEMBL2345965

SCHEMBL2345965

COc1ccc(C(=O)OCc2c(-c3ccc(OC)c(OC)c3OC)ccc3c2C(C)=CC(C)(C)N3)cc1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 15/20 0.42
PGR P06401 7/20 0.42
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL2393891 0.88 MAPT (0.43) NR3C1PGRALDH1A1KDM4EMEN1
SCHEMBL1828562 0.87 MAPT (0.43) NR3C1PGRALDH1A1KDM4EMEN1
SCHEMBL2405791 0.87 PGR (0.48) NR3C1PGRALDH1A1KDM4EMEN1
SCHEMBL2397433 0.87 PGR (0.48) NR3C1PGRALDH1A1KDM4EMEN1
SCHEMBL446281 0.86 PGR (0.47) NR3C1PGRALDH1A1KDM4EMEN1
SCHEMBL12236921 0.86 PGR (0.47) NR3C1PGRALDH1A1KDM4EMEN1
SCHEMBL12236738 0.85 NR3C1 (0.47) NR3C1PGR
SCHEMBL2354139 0.85 NR3C1 (0.42) NR3C1PGR
SCHEMBL2394270 0.85 NR3C1 (0.44) NR3C1PGRALDH1A1KDM4EMEN1
SCHEMBL1827697 0.85 NR3C1 (0.47) NR3C1PGRALDH1A1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8008497-B2 1,2-dihydroquinoline derivative having (substituted phenyl or substituted heterocyclic) carbonyloxy lower alkyl group and ester-introduced phenyl group as substituents SANTEN PHARMACEUTICAL CO., LTD. (JP) 2011-08-30 US disclosed
US-20090298826-A1 NOVEL 1,2-DIHYDROQUINOLINE DERIVATIVE HAVING (SUBSTITUTED PHENYL OR SUBSTITUTED HETEROCYCLIC) CARBONYLOXY LOWER ALKYL GROUP AND ESTER-INTRODUCED PHENYL GROUP AS SUBSTITUENTS SANTEN PHARMACEUTICAL CO., LTD. (JP) 2009-12-03 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 (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-20090298826-A1 NOVEL 1,2-DIHYDROQUINOLINE DERIVATIVE HAVING (SUBSTITUTED PHENYL OR SUBSTITUTED HETEROCYCLIC) CARBONYLOXY LOWER ALKYL GROUP AND ESTER-INTRODUCED PHENYL GROUP AS SUBSTITUENTS NR3C1, NR3C2, NR5A1 NR3C1 1/4885PGR 68/4885ALDH1A1 2905/4885

“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.