SCHEMBL3053569

SCHEMBL3053569

CCNc1nc(-c2ccc(NC(=O)NCc3cccnc3)cc2)ccc1C(=O)NCc1ccccn1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 5/20 0.54
POLB P06746 1/20 0.50
RAB9A P51151 1/20 0.50
NPC1 O15118 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
KMT2A Q03164 4/20 0.47
MEN1 O00255 2/20 0.46
LMNA P02545 1/20 0.46
HPGD P15428 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
SCHEMBL3051289 0.93 NAMPT (0.50) NAMPTPOLBRAB9AKMT2AMEN1
SCHEMBL3058637 0.93 POLB (0.58) NAMPTPOLBL3MBTL1KMT2AMEN1
SCHEMBL3044935 0.91 NAMPT (0.55) NAMPTPOLBRAB9ANPC1L3MBTL1
SCHEMBL3045301 0.89 POLB (0.51) NAMPTPOLBKMT2AMEN1
SCHEMBL3042684 0.89 POLB (0.54) NAMPTPOLBKMT2AMEN1
SCHEMBL3054341 0.89 POLB (0.56) NAMPTPOLBKMT2AMEN1
SCHEMBL3052786 0.87 POLB (0.53) NAMPTPOLBKMT2AMEN1
SCHEMBL3060592 0.87 POLB (0.55) NAMPTPOLBL3MBTL1KMT2AMEN1
SCHEMBL3055841 0.87 POLB (0.55) NAMPTPOLBKMT2AMEN1
SCHEMBL3052906 0.85 POLB (0.58) NAMPTPOLBL3MBTL1KMT2AMEN1

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 4 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
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 1463/4885RAB9A 1217/4885

“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.