SCHEMBL6803700

SCHEMBL6803700

C1CCN([C]2CNCC[N]2)CC1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
HRH1 P35367 1/20 0.38
CASP1 P29466 1/20 0.32
CASP4 P49662 1/20 0.32
CASP5 P51878 1/20 0.32
INMT O95050 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
HRH4 Q9H3N8 1/20 0.32
ALDH1A1 P00352 2/20 0.31
TSHR P16473 1/20 0.31
LMNA P02545 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL5567898 0.85 HRH1 (0.39) USP2SMN1; SMN2TDP1HRH1CASP1
SCHEMBL368445 0.60 HTR2C (0.47) USP2SMN1; SMN2TDP1HRH1CASP1
SCHEMBL5634363 0.58 USP2 (0.36) USP2SMN1; SMN2TDP1HRH1HTR2C
SCHEMBL13460691 0.58 USP2 (0.45) USP2SMN1; SMN2TDP1HRH1INMT
SCHEMBL778188 0.58 SMN1; SMN2 (1.00) USP2SMN1; SMN2TDP1HRH1CASP1
SCHEMBL76532 0.58
SCHEMBL3615 0.58
SCHEMBL1771063 0.58
SCHEMBL338532 0.57 HTR2C (0.49) USP2SMN1; SMN2TDP1HRH1CASP1
SCHEMBL16549762 0.55 INMT (0.52) USP2SMN1; SMN2TDP1HRH1INMT

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-20040242639-A1 Phospholipase C inhibitors for use in treating inflammatory disorders JANSSEN PHARMACEUTICA, N.V. (BE) 2004-12-02 US disclosed
WO-2004089901-A2 PHOSPHOLIPASE C INHIBITORS FOR USE IN TREATING INFLAMMATORY DISORDERS JANSSEN PHARMACEUTICA N.V. (BE) 2004-10-21 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-20040242639-A1 Phospholipase C inhibitors for use in treating inflammatory disorders PLA2G4C, PLA2G4B, PLA2G5 USP2 2306/4885SMN1; SMN2 3997/4885TDP1 1705/4885

“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.