SCHEMBL13429015

SCHEMBL13429015

CN1CCN(c2ccc(Oc3cc(=O)[nH]c4ccccc34)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.54
LMNA P02545 1/20 0.54
KIF11 P52732 2/20 0.47
ALDH1A1 P00352 2/20 0.47
HTR6 P50406 1/20 0.46
ALK Q9UM73 1/20 0.46
PDGFRB P09619 2/20 0.44
FGFR1 P11362 2/20 0.44
KDR P35968 2/20 0.44
FLT1 P17948 1/20 0.44
KIT P10721 1/20 0.43
FLT3 P36888 1/20 0.43
CCNC P24863 1/20 0.43
CDK8 P49336 1/20 0.43
HTR3A P46098 1/20 0.42
USP2 O75604 1/20 0.41
MAPT P10636 1/20 0.41
ALOX15 P16050 1/20 0.41
MAP4K1 Q92918 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
SCHEMBL3225576 0.89 KIF11 (0.47) SMN1; SMN2LMNAKIF11ALDH1A1HTR6
SCHEMBL13429057 0.81 ALK (0.48) ALK
SCHEMBL13429075 0.78 CYP1A2 (0.56) SMN1; SMN2LMNAKIF11ALDH1A1
SCHEMBL13429062 0.78 L3MBTL1 (0.60) SMN1; SMN2LMNAALDH1A1MAPT
SCHEMBL13429255 0.78 ALDH1A1 (0.46) SMN1; SMN2LMNAKIF11ALDH1A1PDGFRB
SCHEMBL2008835 0.77 HPGD (0.54) SMN1; SMN2LMNAALDH1A1
SCHEMBL13429021 0.76 TNKS (0.52) ALKFLT3MAP4K1
SCHEMBL13429202 0.76 TLR9 (0.45) ALK
SCHEMBL13429232 0.76 KIF11 (0.47) SMN1; SMN2LMNAKIF11ALDH1A1PDGFRB
SCHEMBL3221527 0.75 KIF11 (0.54) SMN1; SMN2LMNAKIF11ALDH1A1USP2

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-20100068204-A1 4-ARYLOXYQUINOLIN-2(1H)-ONES AS MTOR KINASE AND PI3 KINASE INHIBITORS, FOR USE AS ANTI-CANCER AGENTS WYETH (US) 2010-03-18 US disclosed
US-20100068204-A1 4-ARYLOXYQUINOLIN-2(1H)-ONES AS MTOR KINASE AND PI3 KINASE INHIBITORS, FOR USE AS ANTI-CANCER AGENTS WYETH (US) 2010-03-18 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-20100068204-A1 4-ARYLOXYQUINOLIN-2(1H)-ONES AS MTOR KINASE AND PI3 KINASE INHIBITORS, FOR USE AS ANTI-CANCER AGENTS MTOR, RICTOR, PIK3CA SMN1; SMN2 4072/4885LMNA 4098/4885KIF11 2758/4885

“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.