SCHEMBL3060445

SCHEMBL3060445

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

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.52
KMT2A Q03164 4/20 0.51
MEN1 O00255 2/20 0.51
FLT3 P36888 2/20 0.49
TYRO3 Q06418 2/20 0.49
MERTK Q12866 2/20 0.49
GAS6 Q14393 2/20 0.49
NAMPT P43490 10/20 0.49

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
SCHEMBL3054897 0.92 NAMPT (0.52) POLBKMT2AMEN1FLT3TYRO3
SCHEMBL3055315 0.92 FLT3 (0.56) POLBKMT2AMEN1FLT3TYRO3
SCHEMBL3061150 0.91 NAMPT (0.51) POLBKMT2AMEN1FLT3TYRO3
SCHEMBL3055573 0.89 NAMPT (0.54) POLBKMT2AMEN1NAMPT
SCHEMBL3044691 0.89 NAMPT (0.52) POLBKMT2AMEN1NAMPT
SCHEMBL3058618 0.89 NAMPT (0.54) POLBKMT2AMEN1NAMPT
SCHEMBL3060369 0.88 NAMPT (0.55) POLBKMT2AMEN1NAMPT
SCHEMBL3055667 0.86 NAMPT (0.51) NAMPT
SCHEMBL3058637 0.86 POLB (0.58) POLBKMT2AMEN1NAMPT
SCHEMBL3707122 0.86 TYRO3 (0.45) POLBFLT3TYRO3MERTKGAS6

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 POLB 1463/4885KMT2A 1349/4885MEN1 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.