SCHEMBL4865663

SCHEMBL4865663

O=C(Nn1ccnn1)N1CCCCc2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.50
POLB P06746 2/20 0.49
TSHR P16473 1/20 0.49
RECQL P46063 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
AVPR2 P30518 9/20 0.48
AVPR1A P37288 7/20 0.48
OXTR P30559 4/20 0.48
MAPT P10636 1/20 0.46

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
SCHEMBL24937798 0.77 NOTUM (0.61) NOTUMPOLBTSHRSMN1; SMN2MAPT
SCHEMBL4863870 0.76 NOTUM (0.45) NOTUMPOLBTSHRRECQLSMN1; SMN2
SCHEMBL4867294 0.74 NOTUM (0.62) NOTUMPOLBTSHRRECQLSMN1; SMN2
SCHEMBL5423105 0.72 NOTUM (0.90) NOTUMTSHRSMN1; SMN2AVPR2AVPR1A
SCHEMBL4867471 0.72 TP53 (0.81) POLBSMN1; SMN2MAPT
SCHEMBL4868227 0.72 POLB (0.60) NOTUMPOLBTSHRRECQLSMN1; SMN2
SCHEMBL4863880 0.71 NOTUM (0.48) NOTUMPOLBTSHRSMN1; SMN2AVPR2
SCHEMBL29082763 0.71 SMN1; SMN2 (0.70) NOTUMPOLBTSHRRECQLSMN1; SMN2
SCHEMBL4869023 0.71 TP53 (0.78) POLBSMN1; SMN2MAPT
SCHEMBL30456228 0.71 SMN1; SMN2 (0.69) NOTUMPOLBTSHRRECQLSMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7368444-B2 N-carbamoyl nitrogen-containing fused ring compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-05-06 US disclosed
US-20050101600-A1 N-carbamoyl nitrogen-containing fused ring compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 US disclosed
EP-1475368-A1 N-CARBAMOYL NITROGEN-CONTAINING FUSED RING COMPOUNDS AND DRUGS CONTAINING THESE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2004-11-10 EP 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-20050101600-A1 N-carbamoyl nitrogen-containing fused ring compounds and drugs containing these compounds as the active ingredient CNR1, CNR2, NPSR1 NOTUM 759/4885POLB 2390/4885TSHR 261/4885

“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.