SCHEMBL4569769

SCHEMBL4569769

CB(O)n1cc(CO)c2cccnc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.41
L3MBTL1 Q9Y468 4/20 0.41
LMNA P02545 3/20 0.41
NPC1 O15118 2/20 0.41
HTT P42858 2/20 0.41
RAB9A P51151 2/20 0.41
GAA P10253 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
FEN1 P39748 1/20 0.38
ELANE P08246 7/20 0.35
MAPT P10636 3/20 0.35
ALOX12 P18054 2/20 0.35
TP53 P04637 2/20 0.35
TSHR P16473 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
BRD4 O60885 1/20 0.34
POLB P06746 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL4569768 0.89 FEN1 (0.40) KDM4EFEN1ELANEMAPTTP53
SCHEMBL4569764 0.77 KMT2A (0.45) KDM4EL3MBTL1NPC1RAB9AFEN1
SCHEMBL13044512 0.77 DYRK1A (0.47) KDM4EL3MBTL1LMNANPC1HTT
SCHEMBL4569770 0.76 CYP19A1 (0.34) NPC1RAB9ABRD4
SCHEMBL4569772 0.73 SMN1; SMN2 (0.43) KDM4EL3MBTL1LMNANPC1HTT
SCHEMBL18616126 0.70 KDM4E (0.42) KDM4EL3MBTL1LMNANPC1HTT
SCHEMBL11027996 0.70 ELANE (0.48) KDM4EL3MBTL1LMNANPC1HTT
SCHEMBL30940044 0.67 L3MBTL1 (0.47) L3MBTL1ELANEBRD4POLB
SCHEMBL3705482 0.67 L3MBTL1 (0.47) L3MBTL1ELANEBRD4POLB
SCHEMBL2024287 0.65 HTR6 (0.56) KDM4EL3MBTL1NPC1HTTGAA

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-8648086-B2 5,6-bicyclic heteroaryl-containing urea compounds as kinase inhibitors ASCEPION PHARMACEUTICALS, INC. (CN) 2014-02-11 US disclosed
US-20120122895-A1 5,6-BICYCLIC HETEROARYL-CONTAINING UREA COMPOUNDS AS KINASE INHIBITORS JIANG, SHAN 2012-05-17 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-20120122895-A1 5,6-BICYCLIC HETEROARYL-CONTAINING UREA COMPOUNDS AS KINASE INHIBITORS FLT3, CSF1R, EPHA2 KDM4E 1145/4885L3MBTL1 4116/4885LMNA 4276/4885

“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.