SCHEMBL13063628

SCHEMBL13063628

Cc1c(-c2ccccn2)nc2ccccc2c1C

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.59
KDM4E B2RXH2 3/20 0.59
METAP1 P53582 5/20 0.49
RAB9A P51151 3/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
ALDH1A1 P00352 3/20 0.46
LMNA P02545 3/20 0.46
HIF1A Q16665 2/20 0.46
GAA P10253 2/20 0.46
HTT P42858 1/20 0.46
MAPT P10636 4/20 0.46
RECQL P46063 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
POLB P06746 2/20 0.44
LRRK2 Q5S007 1/20 0.44
PDE10A Q9Y233 1/20 0.44
AGTR1 P30556 1/20 0.43
CYP1A2 P05177 1/20 0.43
CCR1 P32246 1/20 0.43

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
SCHEMBL2126347 0.85 NPC1 (0.54) NPC1KDM4EMETAP1RAB9AL3MBTL1
SCHEMBL2712438 0.85 NPC1 (0.54) NPC1KDM4EMETAP1RAB9AL3MBTL1
SCHEMBL3782688 0.85 KDM4E (0.54) NPC1KDM4EMETAP1RAB9AL3MBTL1
SCHEMBL27866931 0.82 NPC1 (0.50) NPC1KDM4EMETAP1RAB9AL3MBTL1
SCHEMBL2855425 0.80 KDM4E (0.55) NPC1KDM4EMETAP1RAB9AL3MBTL1
SCHEMBL14084546 0.79 NPC1 (0.54) NPC1KDM4EMETAP1RAB9AL3MBTL1
SCHEMBL2061612 0.77 KDM4E (0.70) NPC1KDM4EMETAP1RAB9AL3MBTL1
SCHEMBL8018580 0.77 KDM4E (0.65) NPC1KDM4EMETAP1RAB9AL3MBTL1
SCHEMBL6509452 0.77 KDM4E (0.55) NPC1KDM4EMETAP1RAB9AL3MBTL1
SCHEMBL12925935 0.76 CYP1A2 (0.55) NPC1KDM4ERAB9AL3MBTL1ALDH1A1

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-20100331293-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2010-12-30 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-20100331293-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, MALT1, BCL9 NPC1 4409/4885KDM4E 2124/4885METAP1 4171/4885

“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.