SCHEMBL4135849

SCHEMBL4135849

CCOC(=O)c1c(C)nc(-c2ccccc2OCc2ccccc2)n(CCc2ccccc2)c1=O

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
CASR P41180 11/20 0.51
TSHR P16473 2/20 0.45
NR1I2 O75469 2/20 0.45
LMNA P02545 3/20 0.45
ALDH1A1 P00352 3/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
HIF1A Q16665 1/20 0.45
KDM4E B2RXH2 2/20 0.43
NPC1 O15118 1/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
RAB9A P51151 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
AR P10275 1/20 0.42

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
SCHEMBL13851744 0.90 MAPT (0.52) MAPTSMN1; SMN2CASRTSHRNR1I2
SCHEMBL28148354 0.90 CASR (0.55) CASRTSHRNR1I2LMNAALDH1A1
SCHEMBL4138084 0.87 CASR (0.69) MAPTSMN1; SMN2CASRNR1I2
SCHEMBL4139326 0.83 CASR (0.54) CASRTSHRNR1I2LMNAALDH1A1
SCHEMBL4143109 0.81 CASR (0.54) CASRTSHRNR1I2LMNAALDH1A1
SCHEMBL4145053 0.81 CASR (0.57) CASRTSHRNR1I2LMNAALDH1A1
SCHEMBL4150847 0.79 CASR (0.52) MAPTCASRTSHRNR1I2LMNA
SCHEMBL4138510 0.79 CASR (0.67) CASRTSHRNR1I2LMNAALDH1A1
SCHEMBL4151020 0.78 CASR (0.51) SMN1; SMN2CASRTSHRNR1I2LMNA
SCHEMBL13851615 0.78 CASR (0.50) CASRTSHRNR1I2LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090137557-A1 Calcilytic Compounds SMITHKLINE BEECHAM CORPORATION 2009-05-28 US disclosed
US-20090137557-A1 Calcilytic Compounds SMITHKLINE BEECHAM CORPORATION 2009-05-28 US disclosed
EP-1951244-A2 CALCILYTIC COMPOUNDS SmithKline Beecham Corporation (US) 2008-08-06 EP disclosed
WO-2007062370-A2 CALCILYTIC COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2007-05-31 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-20090137557-A1 Calcilytic Compounds CALCR, SOST, CALCB MAPT 3353/4885SMN1; SMN2 4164/4885CASR 12/4885

“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.