SCHEMBL4863880

SCHEMBL4863880

CSN(C(=O)N1CCCCc2ccccc21)n1ccnn1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.48
AVPR2 P30518 12/20 0.45
AVPR1A P37288 11/20 0.45
OXTR P30559 6/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
PKM P14618 1/20 0.41
MEN1 O00255 1/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 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
SCHEMBL24937798 0.72 NOTUM (0.61) NOTUMSMN1; SMN2POLBGAAMEN1
SCHEMBL4863683 0.72 AVPR2 (0.57) NOTUMAVPR2AVPR1AOXTRSMN1; SMN2
SCHEMBL4865663 0.71 NOTUM (0.50) NOTUMAVPR2AVPR1AOXTRSMN1; SMN2
SCHEMBL5423105 0.71 NOTUM (0.90) NOTUMAVPR2AVPR1AOXTRSMN1; SMN2
SCHEMBL8563605 0.69 NOTUM (0.69) NOTUMAVPR2AVPR1ASMN1; SMN2POLB
SCHEMBL13473661 0.68 NOTUM (0.62) NOTUMAVPR2AVPR1AOXTRSMN1; SMN2
SCHEMBL29510859 0.67 NOTUM (1.00) NOTUMSMN1; SMN2POLBMEN1TSHR
SCHEMBL30456228 0.67 SMN1; SMN2 (0.69) NOTUMAVPR2AVPR1AOXTRSMN1; SMN2
SCHEMBL709869 0.67 NOTUM (1.00) NOTUMSMN1; SMN2POLBMEN1TSHR
SCHEMBL4861709 0.67 AVPR2 (0.52) NOTUMAVPR2AVPR1AOXTRSMN1; 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 759/4885AVPR2 124/4885AVPR1A 276/4885

“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.