SCHEMBL2318569

SCHEMBL2318569

CNC(C)C(=O)Nc1cc(-c2ccccc2)c(C)n(CC(=O)NCCc2ccccc2)c1=O

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.45
TP53 P04637 6/20 0.45
RXFP1 Q9HBX9 3/20 0.45
SMN1; SMN2 Q16637 1/20 0.42
POLB P06746 2/20 0.42
LMNA P02545 2/20 0.42
PNP P00491 1/20 0.42
MAPK1 P28482 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 2/20 0.41
GLA P06280 1/20 0.41
TSHR P16473 1/20 0.41
KDM4E B2RXH2 1/20 0.41
HPGD P15428 1/20 0.40

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
SCHEMBL12127800 1.00 MAPT (0.45) MAPTTP53RXFP1SMN1; SMN2POLB
SCHEMBL1329937 0.84 ELANE (0.52) MAPTTP53RXFP1
SCHEMBL1329939 0.84 ELANE (0.52) MAPTTP53RXFP1
SCHEMBL2321803 0.84 F2 (0.52) MAPTTP53RXFP1SMN1; SMN2POLB
SCHEMBL2316482 0.81 CASP1 (0.52) MAPTTP53RXFP1SMN1; SMN2POLB
SCHEMBL2316492 0.81 CASP1 (0.52) MAPTTP53RXFP1SMN1; SMN2POLB
SCHEMBL2317237 0.78 CASP1 (0.54) MAPTTP53RXFP1SMN1; SMN2POLB
SCHEMBL2317231 0.78 CASP1 (0.54) MAPTTP53RXFP1SMN1; SMN2POLB
SCHEMBL2317041 0.77 XIAP (0.63) MAPTTP53RXFP1SMN1; SMN2POLB
SCHEMBL2317036 0.77 XIAP (0.63) MAPTTP53RXFP1SMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7989441-B2 Organic compounds NOVARTIS AG (CH) 2011-08-02 US claimed
US-20090069294-A1 Organic Compounds NOVARTIS AG (CH) 2009-03-12 US claimed

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-20090069294-A1 Organic Compounds XIAP, BAX, MCL1 MAPT 1521/4885TP53 7/4885RXFP1 4864/4885

“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.