SCHEMBL4397158

SCHEMBL4397158

O=C1CN(C(=O)OCc2ccccc2)C2CCCCC2N1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
GAA P10253 1/20 0.46
MAPK1 P28482 1/20 0.46
PREP P48147 2/20 0.46
CTSK P43235 2/20 0.46
CTSB P07858 1/20 0.46
CTSS P25774 1/20 0.46
PSEN1 P49768 1/20 0.46
PSEN2 P49810 1/20 0.46
APH1B Q8WW43 1/20 0.46
NCSTN Q92542 1/20 0.46
APH1A Q96BI3 1/20 0.46
PSENEN Q9NZ42 1/20 0.46
HTR2C P28335 1/20 0.44
CYP2C19 P33261 1/20 0.43

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
SCHEMBL4397156 1.00 SMN1; SMN2 (0.46) SMN1; SMN2NPC1RAB9AGAAMAPK1
SCHEMBL18428256 0.83 ELANE (0.48) SMN1; SMN2NPC1RAB9APREPCTSK
SCHEMBL7405709 0.81 SMN1; SMN2 (0.48) SMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL34474262 0.81 SMN1; SMN2 (0.48) SMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL1190472 0.79 PREP (0.49) SMN1; SMN2NPC1RAB9APREPHTR2C
SCHEMBL10169571 0.78 PREP (0.54) SMN1; SMN2NPC1RAB9APREP
SCHEMBL928649 0.76 HTR2C (0.50) SMN1; SMN2NPC1RAB9APREPPSEN1
SCHEMBL9599486 0.76 SMN1; SMN2 (0.46) SMN1; SMN2NPC1RAB9AGAAMAPK1
SCHEMBL9599489 0.76 SMN1; SMN2 (0.46) SMN1; SMN2NPC1RAB9AGAAMAPK1
SCHEMBL9599494 0.76 SMN1; SMN2 (0.46) SMN1; SMN2NPC1RAB9AGAAMAPK1

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-7612075-B2 Substituted oxoazaheterocyclyl compounds AVENTIS PHARMACEUTICALS INC. (US) 2009-11-03 US disclosed
US-20040102450-A1 Substituted oxoazaheterocyclyl compounds AVENTIS PHARMACEUTICALS INC. (US) 2004-05-27 US disclosed
EP-1208097-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS Aventis Pharmaceuticals Inc. (US) 2002-05-29 EP disclosed
WO-2001007436-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS AVENTIS PHARMACEUTICALS INC. (US) 2001-02-01 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-20040102450-A1 Substituted oxoazaheterocyclyl compounds F13B, F9, F11 SMN1; SMN2 4142/4885NPC1 2223/4885RAB9A 1986/4885

“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.