SCHEMBL4364056

SCHEMBL4364056

O=C(Cc1nc2cccnc2s1)Nc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.54
KMT2A Q03164 4/20 0.54
LMNA P02545 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
MEN1 O00255 3/20 0.54
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
NPSR1 Q6W5P4 2/20 0.54
NFKB1 P19838 2/20 0.54
NFKB2 Q00653 2/20 0.54
RELA Q04206 2/20 0.54
KDM4E B2RXH2 1/20 0.54
RECQL P46063 1/20 0.54
L3MBTL1 Q9Y468 2/20 0.52
TP53 P04637 1/20 0.51
THRB P10828 1/20 0.51
AKR1B1 P15121 1/20 0.49
POLB P06746 2/20 0.46
EPHX2 P34913 1/20 0.46
HTT P42858 1/20 0.46

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
SCHEMBL11343437 0.82 LMNA (0.71) MAPTKMT2ALMNASMN1; SMN2MEN1
SCHEMBL4929694 0.74 HDAC6 (0.53) MAPTKMT2ALMNASMN1; SMN2MEN1
SCHEMBL11737799 0.74 AURKA (0.56) MAPTKMT2ALMNASMN1; SMN2MEN1
SCHEMBL12212298 0.73 LIPG (0.48) MAPTKMT2ALMNASMN1; SMN2MEN1
SCHEMBL1628148 0.73 MAPT (0.42) MAPTKMT2ALMNASMN1; SMN2MEN1
SCHEMBL14421725 0.73 PDK1 (0.53) MAPTKMT2ALMNASMN1; SMN2MEN1
SCHEMBL11415710 0.70 L3MBTL1 (0.59) MAPTKMT2ALMNASMN1; SMN2MEN1
SCHEMBL7831752 0.70 ALOX15 (0.57) MAPTLMNASMN1; SMN2AKR1B1HTT
SCHEMBL2028409 0.70 CA1 (0.69) KMT2ALMNASMN1; SMN2MEN1NPC1
SCHEMBL7835421 0.70 HDAC1 (0.49) LMNA

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-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 4500/4885KMT2A 3276/4885LMNA 2300/4885

“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.