SCHEMBL2544665

SCHEMBL2544665

CCCC(=O)Oc1ccc(-c2ccc3c(c2C(OC=O)c2ccc(C)s2)C(C)=CC(C)(C)N3)c(OC)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.40
LMNA P02545 5/20 0.40
ALDH1A1 P00352 5/20 0.40
NPSR1 Q6W5P4 4/20 0.40
HTT P42858 5/20 0.38
KDM4E B2RXH2 4/20 0.38
G6PD P11413 2/20 0.38
TP53 P04637 2/20 0.38
GFER P55789 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NR3C1 P04150 13/20 0.36
PGR P06401 3/20 0.36
AR P10275 2/20 0.36
NR3C2 P08235 1/20 0.36
ALOX15 P16050 1/20 0.36
ALOX12 P18054 1/20 0.36

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
SCHEMBL17667953 0.88 NR3C1 (0.47) MAPTLMNAALDH1A1NPSR1HTT
SCHEMBL4428816 0.86 MAPT (0.44) MAPTLMNAALDH1A1NPSR1HTT
SCHEMBL17667944 0.84 MAPT (0.39) MAPTLMNAALDH1A1NPSR1HTT
SCHEMBL2346391 0.84 MAPT (0.41) MAPTLMNAALDH1A1NPSR1HTT
SCHEMBL2354785 0.83 MAPT (0.36) MAPTLMNAALDH1A1NPSR1HTT
SCHEMBL2395852 0.83 PGR (0.44) NR3C1PGRARNR3C2
SCHEMBL2393572 0.82 KDM4E (0.41) MAPTALDH1A1KDM4EHSD17B10MEN1
SCHEMBL2356050 0.82 MAPT (0.40) MAPTLMNAALDH1A1NPSR1HTT
SCHEMBL2541110 0.81 PGR (0.40) NR3C1PGRAR
SCHEMBL1779385 0.79 NR3C1 (0.34) MAPTALDH1A1NPSR1HTTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2085389-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) 2009-08-05 EP claimed
US-8563551-B2 Method for preventing or treating a disease related to the glucocorticoid receptor SANTEN PHARMACEUTICAL CO., LTD. (JP) 2013-10-22 US disclosed
EP-2085389-B1 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) 2012-09-26 EP disclosed
US-20110263600-A1 Method for preventing or treating a disease related to the glucocorticoid receptor SANTEN PHARMACEUTICAL CO., LTD. 2011-10-27 US disclosed
EP-2085389-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) 2009-08-05 EP 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-20110263600-A1 Method for preventing or treating a disease related to the glucocorticoid receptor NR3C1, NR3C2, MC2R MAPT 3341/4885LMNA 2023/4885ALDH1A1 3105/4885

“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.