SCHEMBL12190884

SCHEMBL12190884

O=C(Nc1ccccc1)c1cncc(-c2ccc(O)cc2)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNC P24863 1/20 0.62
CDK8 P49336 1/20 0.62
DEGS1 O15121 1/20 0.61
PTPN1 P18031 3/20 0.57
SCN10A Q9Y5Y9 5/20 0.55
KAT6A Q92794 1/20 0.53
SMO Q99835 1/20 0.53
POLB P06746 1/20 0.52
STAT3 P40763 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
NPC1 O15118 1/20 0.52
LMNA P02545 1/20 0.52
GAA P10253 1/20 0.52
NAMPT P43490 1/20 0.52
RAB9A P51151 1/20 0.52
KCNH2 Q12809 2/20 0.52
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
SCN2A Q99250 1/20 0.51
HTT P42858 1/20 0.50

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
SCHEMBL27828390 0.91 CCNC (0.64) CCNCCDK8PTPN1SCN10AKAT6A
SCHEMBL12191060 0.87 SCN10A (0.72) CCNCCDK8PTPN1SCN10ASMO
SCHEMBL27828346 0.87 HTT (0.64) CCNCCDK8PTPN1SCN10APOLB
SCHEMBL485860 0.84 CCNC (0.64) CCNCCDK8PTPN1SCN10ASMO
SCHEMBL14640457 0.84 KCNK9 (0.59) CCNCCDK8PTPN1SCN10APOLB
SCHEMBL12191048 0.83 ABL1 (0.68) CCNCCDK8SMN1; SMN2NPC1LMNA
SCHEMBL12190912 0.82 CCNC (0.53) CCNCCDK8PTPN1SCN10ANPC1
SCHEMBL12190908 0.81 CCNC (0.65) CCNCCDK8SCN10APOLBSMN1; SMN2
SCHEMBL27984049 0.81 MEN1 (0.74) CCNCCDK8DEGS1PTPN1POLB
SCHEMBL23390206 0.80 ABL1 (0.79) SCN10AKCNH2ABL1OPRM1

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-8030336-B2 Nicotinamide-based kinase inhibitors YM BIOSCIENCES AUSTRALIA PTY LTD (AU) 2011-10-04 US disclosed
US-8030336-B2 Nicotinamide-based kinase inhibitors YM BIOSCIENCES AUSTRALIA PTY LTD (AU) 2011-10-04 US disclosed
US-20070060619-A1 Nicotinamide-based kinase inhibitors CYTOPIA PTY LTD (AU) 2007-03-15 US disclosed
US-20070060619-A1 Nicotinamide-based kinase inhibitors CYTOPIA PTY LTD (AU) 2007-03-15 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-20070060619-A1 Nicotinamide-based kinase inhibitors NADK, NAMPT, PDXK CCNC 1755/4885CDK8 218/4885DEGS1 2831/4885

“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.