SCHEMBL3054897

SCHEMBL3054897

CNC(=O)c1ccc(-c2ccc(NC(=O)NCc3cccnc3)cc2)nc1NC1CC1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 13/20 0.52
POLB P06746 1/20 0.51
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
CYP2C9 P11712 2/20 0.48
FLT3 P36888 1/20 0.48
TYRO3 Q06418 1/20 0.48
MERTK Q12866 1/20 0.48
GAS6 Q14393 1/20 0.48

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
SCHEMBL3044691 0.97 NAMPT (0.52) NAMPTPOLBMEN1KMT2ACYP2C9
SCHEMBL3058618 0.97 NAMPT (0.54) NAMPTPOLBMEN1KMT2ACYP2C9
SCHEMBL3060369 0.96 NAMPT (0.55) NAMPTPOLBMEN1KMT2ACYP2C9
SCHEMBL3060445 0.92 POLB (0.52) NAMPTPOLBMEN1KMT2AFLT3
SCHEMBL3061150 0.92 NAMPT (0.51) NAMPTPOLBMEN1KMT2ACYP2C9
SCHEMBL3055573 0.90 NAMPT (0.54) NAMPTPOLBMEN1KMT2A
SCHEMBL3055315 0.89 FLT3 (0.56) NAMPTPOLBMEN1KMT2AFLT3
SCHEMBL3050146 0.88 NAMPT (0.56) NAMPTPOLBMEN1KMT2A
SCHEMBL3055579 0.88 NAMPT (0.51) NAMPTPOLBMEN1KMT2ACYP2C9
SCHEMBL3054771 0.87 NAMPT (0.54) NAMPTPOLBMEN1KMT2A

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 1463/4885MEN1 1485/4885

“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.