SCHEMBL2355752

SCHEMBL2355752

COc1cc(OC(=O)c2ccccc2Cl)ccc1-c1ccc2c(c1C(O)Cc1ccc(Br)s1)C(C)=CC(C)(C)N2

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.39
LMNA P02545 6/20 0.39
HTT P42858 5/20 0.39
NPSR1 Q6W5P4 5/20 0.39
TP53 P04637 2/20 0.39
NR3C1 P04150 12/20 0.37
NR3C2 P08235 1/20 0.37
AR P10275 1/20 0.37
PGR P06401 4/20 0.36
TDP1 Q9NUW8 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
HSD17B10 Q99714 1/20 0.36
SMN1; SMN2 Q16637 4/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 3/20 0.35
HPGD P15428 2/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL2350973 0.87 MAPT (0.55) MAPTLMNAHTTNPSR1TP53
SCHEMBL2355751 0.86 MAPT (0.38) MAPTLMNAHTTNPSR1TP53
SCHEMBL2350106 0.85 LMNA (0.56) MAPTLMNAHTTNPSR1TP53
SCHEMBL2355734 0.82 PGR (0.43) NR3C1NR3C2ARPGR
SCHEMBL1780139 0.82 MAPT (0.38) MAPTLMNAHTTNPSR1TP53
SCHEMBL1780365 0.80 MAPT (0.41) MAPTLMNAHTTNPSR1TP53
SCHEMBL2350297 0.80 HTT (0.41) MAPTLMNAHTTNPSR1TP53
SCHEMBL2354784 0.79 MAPT (0.44) MAPTLMNAHTTNPSR1TP53
SCHEMBL2349555 0.79 NR3C1 (0.38) NR3C1NR3C2ARPGR
SCHEMBL2351050 0.78 MAPT (0.39) MAPTLMNAHTTNPSR1TP53

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 MAPT 4861/4885LMNA 4460/4885HTT 4825/4885

“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.