SCHEMBL4925538

SCHEMBL4925538

COc1ccc(-n2ncc3c(Nc4c(C)cccc4C)ncnc32)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.72
NPC1 O15118 8/20 0.72
RAB9A P51151 8/20 0.72
KDM4E B2RXH2 8/20 0.72
SMN1; SMN2 Q16637 7/20 0.72
ALDH1A1 P00352 6/20 0.72
GAA P10253 2/20 0.72
MEN1 O00255 2/20 0.72
KMT2A Q03164 2/20 0.72
MAPK1 P28482 3/20 0.65
TDP1 Q9NUW8 1/20 0.65
TP53 P04637 9/20 0.65
HSD17B10 Q99714 8/20 0.65
LMNA P02545 5/20 0.65
HPGD P15428 5/20 0.65
POLB P06746 1/20 0.63
NFKB1 P19838 1/20 0.61
NFKB2 Q00653 1/20 0.61
RELA Q04206 1/20 0.61
HTT P42858 2/20 0.61

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
SCHEMBL4926416 0.90 MAPT (0.72) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL4926128 0.89 TP53 (0.79) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL31615154 0.83 MAPT (0.84) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL4924582 0.81 TP53 (0.59) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL6206370 0.81 KDM4E (0.73) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL4923684 0.80 LMNA (0.75) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL4930831 0.80 LMNA (0.74) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL10016528 0.79 RAB9A (1.00) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL4924472 0.77 TP53 (0.53) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL4923741 0.76 TP53 (0.52) MAPTNPC1RAB9AKDM4ESMN1; SMN2

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-20080096868-A1 1,4 Substituted Pyrazolopyrimidines as Kinase Inhibitors NOVARTIS AG (CH) 2008-04-24 US claimed
US-20080096868-A1 1,4 Substituted Pyrazolopyrimidines as Kinase Inhibitors NOVARTIS AG (CH) 2008-04-24 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-20080096868-A1 1,4 Substituted Pyrazolopyrimidines as Kinase Inhibitors MAP3K1, MAP4K2, MAP4K5 MAPT 1638/4885NPC1 1579/4885RAB9A 2015/4885

“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.