SCHEMBL1628148

SCHEMBL1628148

NC(C(=O)Nc1ccccc1)c1nc2cccnc2s1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.42
NPC1 O15118 6/20 0.42
RAB9A P51151 6/20 0.42
KDM4E B2RXH2 5/20 0.42
SMN1; SMN2 Q16637 5/20 0.42
HPGD P15428 4/20 0.42
HSD17B10 Q99714 3/20 0.42
ALDH1A1 P00352 3/20 0.42
LMNA P02545 3/20 0.42
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
TP53 P04637 2/20 0.42
HTT P42858 2/20 0.42
ATM Q13315 1/20 0.42
POLB P06746 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
STAT1 P42224 1/20 0.42
PDK1 Q15118 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL11415663 0.76 AURKA (0.52) NPC1RAB9ASMN1; SMN2HPGDHSD17B10
SCHEMBL4364050 0.73 PDK1 (0.41) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL4364056 0.73 MAPT (0.54) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL4929686 0.72 PDK1 (0.45) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL2624385 0.70 PDK1 (0.53) NPC1RAB9AKDM4ESMN1; SMN2HPGD
SCHEMBL31003221 0.68 PDK1 (0.50) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL11132902 0.68 LMNA (0.51) MAPTSMN1; SMN2ALDH1A1LMNAKMT2A
SCHEMBL1628150 0.68 PDK1 (0.38) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL19074543 0.66 POLB (0.66) MAPTNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL4982071 0.66 POLB (0.66) MAPTNPC1RAB9ASMN1; SMN2HPGD

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-7928140-B2 Benzothiazole PI3 kinase modulators for cancer treatment AMGEN INC. (US) 2011-04-19 US disclosed
US-20090054405-A1 PI3 kinase modulators and methods of use AMGEN INC. (US) 2009-02-26 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-20090054405-A1 PI3 kinase modulators and methods of use PIK3CA, PIK3C2A, PIK3C2B MAPT 4500/4885NPC1 2720/4885RAB9A 971/4885

“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.