SCHEMBL2533133

SCHEMBL2533133

O=C(Nc1nc2c(Sc3cnc4ccccn34)cccc2s1)C1CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.51
RAB9A P51151 4/20 0.51
KMT2A Q03164 5/20 0.49
MEN1 O00255 4/20 0.49
CHKA P35790 3/20 0.41
CHKB Q9Y259 3/20 0.41
ALDH1A1 P00352 2/20 0.39
HSD17B10 Q99714 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 1/20 0.39
TP53 P04637 1/20 0.39
POLB P06746 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
AHR P35869 1/20 0.39
ADORA2A P29274 1/20 0.39
ABL1 P00519 2/20 0.38
MAPT P10636 2/20 0.38

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
SCHEMBL2533142 0.81 CASP3 (0.51) NPC1RAB9AKMT2AMEN1ALDH1A1
SCHEMBL1841257 0.69 CASP3 (0.50) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL2546957 0.69 NPC1 (0.43) NPC1RAB9AKMT2AMEN1KDM4E
SCHEMBL2534684 0.67 MET (0.60) NPC1RAB9AKMT2AMEN1ALDH1A1
SCHEMBL2529642 0.66 MET (0.54) ABL1SENP7
SCHEMBL2530711 0.66 MET (0.61) NPC1RAB9AKMT2AMEN1ABL1
SCHEMBL880500 0.66 GAA (0.76) NPC1RAB9AKMT2AMEN1ALDH1A1
SCHEMBL1838470 0.65 CASP3 (0.45) NPC1RAB9AKMT2AMEN1ALDH1A1
SCHEMBL2542571 0.65 ABL1 (0.56) NPC1RAB9AKMT2AMEN1CHKA
SCHEMBL2541319 0.64 MET (0.46) NPC1RAB9AKMT2AMEN1ABL1

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-20110257171-A1 NOVEL IMIDAZO[1,2-A]PYRIDINE DERIVATIVES, METHOD FOR THE PREPARATION THEREOF, USE THEREOF AS MEDICAMENTS, PHARMACEUTICAL COMPOSITIONS AND NOVEL USE IN PARTICULAR AS MET INHIBITORS SANOFI-AVENTIS (FR) 2011-10-20 US claimed
US-20110257171-A1 NOVEL IMIDAZO[1,2-A]PYRIDINE DERIVATIVES, METHOD FOR THE PREPARATION THEREOF, USE THEREOF AS MEDICAMENTS, PHARMACEUTICAL COMPOSITIONS AND NOVEL USE IN PARTICULAR AS MET INHIBITORS SANOFI-AVENTIS (FR) 2011-10-20 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-20110257171-A1 NOVEL IMIDAZO[1,2-A]PYRIDINE DERIVATIVES, METHOD FOR THE PREPARATION THEREOF, USE THEREOF AS MEDICAMENTS, PHARMACEUTICAL COMPOSITIONS AND NOVEL USE IN PARTICULAR AS MET INHIBITORS MET, ALK, RET NPC1 1594/4885RAB9A 1642/4885KMT2A 1457/4885

“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.