SCHEMBL13699015

SCHEMBL13699015

COc1ccc2c(c1)OCCCN2C(C)=O

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.57
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
THRB P10828 2/20 0.50
TP53 P04637 3/20 0.49
HSD17B10 Q99714 1/20 0.47
TDP1 Q9NUW8 1/20 0.44
KDR P35968 3/20 0.43
POLB P06746 3/20 0.43
MAPT P10636 2/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD17B3 P37058 1/20 0.43
LCK P06239 2/20 0.42
MET P08581 1/20 0.42
RIPK1 Q13546 1/20 0.41
TRIM24 O15164 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
SCHEMBL13699025 0.92 NOTUM (0.60) NOTUMMEN1KMT2ATHRBTP53
SCHEMBL31371813 0.84 USP30 (0.43) NOTUMMEN1KMT2ATHRBTP53
SCHEMBL6985785 0.81 KMT2A (0.60) NOTUMMEN1KMT2ATHRBTP53
SCHEMBL2060747 0.81 NOTUM (0.52) NOTUMMEN1KMT2ATHRBHSD17B10
SCHEMBL31371786 0.79 DRD2 (0.45) NOTUMTHRBLMNAMET
SCHEMBL1854653 0.77 KDR (0.48) NOTUMMEN1KMT2ATHRBTP53
SCHEMBL25937783 0.76 KDR (0.48) MEN1KMT2ATHRBTP53KDR
SCHEMBL2062244 0.76 NOTUM (0.48) NOTUMMEN1KMT2ATHRBMAPT
SCHEMBL2203840 0.76 NOTUM (0.83) NOTUMMEN1KMT2ATP53HSD17B10
SCHEMBL13699019 0.73 NOTUM (0.68) NOTUMMEN1KMT2ATHRBTP53

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-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 US disclosed
US-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 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-20090233910-A1 Npy antagonists, preparation and uses NPY1R, NPY5R, NPY2R NOTUM 2609/4885MEN1 2447/4885KMT2A 3436/4885

“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.