SCHEMBL13429341

SCHEMBL13429341

CN(C)CCCN1CCN(c2cccc(Oc3cc(=O)[nH]c4ccccc34)c2)CC1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 10/20 0.45
HTR2A P28223 2/20 0.45
HTR2C P28335 2/20 0.45
DRD2 P14416 1/20 0.45
HRH1 P35367 1/20 0.45
KCNH2 Q12809 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPT P10636 2/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
DRD3 P35462 1/20 0.43
MEN1 O00255 1/20 0.43
HTR7 P34969 2/20 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 0.84 KIF11 (0.47) KMT2AMAPTALDH1A1LMNA
SCHEMBL13429255 0.78 ALDH1A1 (0.46) KMT2AMAPTALDH1A1LMNAMEN1
SCHEMBL13429015 0.74 SMN1; SMN2 (0.54) MAPTALDH1A1LMNA
SCHEMBL13429209 0.71 KDM4E (0.44) HTR1AHTR2AHTR2CDRD2KMT2A
SCHEMBL3209472 0.70 TLR9 (0.49)
SCHEMBL13429205 0.70 KDM4E (0.56) KMT2AALDH1A1MEN1
SCHEMBL3224822 0.70 DRD2 (0.42) DRD2KMT2ADRD3MEN1
SCHEMBL13429069 0.70 CYP1A2 (0.53) KMT2AMAPTALDH1A1MEN1
SCHEMBL13429074 0.70 ABCG2 (0.51) KMT2AMAPTALDH1A1LMNAMEN1
SCHEMBL3224936 0.70 MAOB (0.47) MAPTALDH1A1

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 HTR1A 3577/4885HTR2A 3059/4885HTR2C 2370/4885

“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.