SCHEMBL14596131

SCHEMBL14596131

N#Cc1cccc2c(-c3c(P(=O)(c4ccccc4)c4ccccc4)ccc4c(C#N)cccc34)c(P(=O)(c3ccccc3)c3ccccc3)ccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
KCNA5 P22460 1/20 0.36
PNMT P11086 1/20 0.35
IMPDH2 P12268 1/20 0.35
IMPDH1 P20839 1/20 0.35
NPSR1 Q6W5P4 2/20 0.34
SLC22A12 Q96S37 2/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
STAT3 P40763 1/20 0.33
AR P10275 1/20 0.33
TOP1 P11387 1/20 0.32
POLB P06746 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 2/20 0.31
ALDH1A1 P00352 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
DYRK1A Q13627 1/20 0.31

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
SCHEMBL1305767 0.85 NPSR1 (0.37) NPSR1KMT2AMEN1TOP1POLB
SCHEMBL6053344 0.79 SLC22A12 (0.42) CA1CA2KCNA5SLC22A12AR
SCHEMBL13536496 0.76 NPSR1 (0.36) CA2NPSR1KMT2AMEN1TOP1
SCHEMBL14596137 0.76 KMT2A (0.40) CA2NPSR1KMT2AMEN1TOP1
SCHEMBL14596143 0.73 KMT2A (0.35) PNMTNPSR1KMT2AMEN1TOP1
SCHEMBL29382484 0.72 WDR5 (0.44) CA2NPSR1POLBKDM4EMAPT
SCHEMBL132989 0.72 WDR5 (0.44) CA2NPSR1POLBKDM4EMAPT
SCHEMBL12113510 0.71 NPSR1 (0.38) NPSR1KMT2AMEN1POLBKDM4E
SCHEMBL20256690 0.71 CA1 (0.37) CA1CA2KCNA5NPSR1KMT2A
SCHEMBL20256941 0.71 PDE10A (0.38) CA1CA2KCNA5IMPDH2IMPDH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070010695-A1 Diphosphines, preparation and uses thereof CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2007-01-11 US 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-20070010695-A1 Diphosphines, preparation and uses thereof MPI, ITPA, DCPS CA1 3712/4885CA2 2115/4885KCNA5 3473/4885

“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.