SCHEMBL3048680

SCHEMBL3048680

CCNc1nc(-c2ccc(NC(=O)NCc3cccnc3)cc2)ccc1C(=O)NCCN1CCNCC1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 13/20 0.50
POLB P06746 1/20 0.46
CYP2C9 P11712 2/20 0.45
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 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
SCHEMBL3058510 0.93 NAMPT (0.51) NAMPTPOLB
SCHEMBL3051516 0.93 NAMPT (0.51) NAMPTPOLB
SCHEMBL3048788 0.93 NAMPT (0.48) NAMPTPOLBKMT2AMEN1
SCHEMBL3058645 0.91 NAMPT (0.51) NAMPTPOLBKMT2AMEN1
SCHEMBL3057603 0.91 POLB (0.45) NAMPTPOLBCYP2C9
SCHEMBL3052781 0.90 NAMPT (0.46) NAMPTPOLBKMT2AMEN1
SCHEMBL3050169 0.89 NAMPT (0.46) NAMPTPOLBCYP2C9KMT2A
SCHEMBL3052000 0.88 CHRNA7 (0.53) NAMPTPOLB
SCHEMBL3055073 0.88 CHRNA7 (0.57) NAMPTPOLB
SCHEMBL3058637 0.87 POLB (0.58) NAMPTPOLBKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100222319-A1 NICOTINAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-09-02 US claimed
EP-2205566-A2 NICOTINAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2010-07-14 EP claimed
WO-2009074749-A2 NICOTINAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2009-06-18 WO claimed
US-20100222319-A1 NICOTINAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-09-02 US disclosed
EP-2205566-A2 NICOTINAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2010-07-14 EP disclosed
WO-2009074749-A2 NICOTINAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2009-06-18 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-20100222319-A1 NICOTINAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF NNT, NAMPT, NQO1 NAMPT 2/4885POLB 1463/4885CYP2C9 923/4885

“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.