SCHEMBL3387693

SCHEMBL3387693

Cc1ccnc(-c2cccnc2C(=O)O)c1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.46
ALDH1A1 P00352 3/20 0.46
MAPT P10636 2/20 0.46
BLM P54132 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
CYP3A4 P08684 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
AGER Q15109 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
MYC P01106 1/20 0.45
TDP1 Q9NUW8 2/20 0.43
CYP1A2 P05177 1/20 0.41
TDP2 O95551 1/20 0.38
NSD2 O96028 1/20 0.38
ABL1 P00519 1/20 0.38
PLCG1 P19174 1/20 0.38
CES1 P23141 1/20 0.38
PAX8 Q06710 1/20 0.38
RIN1 Q13671 1/20 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
SCHEMBL14861469 0.79 KDM4E (0.50) KDM4EALDH1A1MAPTBLML3MBTL1
SCHEMBL7199668 0.77 KDM4E (0.47) KDM4EALDH1A1MAPTBLML3MBTL1
SCHEMBL31265696 0.77 KDM4E (0.52) KDM4EALDH1A1MAPTBLML3MBTL1
SCHEMBL698990 0.77 KDM4E (0.52) KDM4EALDH1A1MAPTBLML3MBTL1
SCHEMBL2403531 0.76 NUDT1 (0.43) KDM4EALDH1A1MAPTBLML3MBTL1
SCHEMBL28468318 0.76 KDM4E (0.50) KDM4EALDH1A1MAPTBLML3MBTL1
SCHEMBL30719725 0.75 KDM4E (0.53) KDM4EALDH1A1MAPTBLML3MBTL1
SCHEMBL130171 0.74 KDM4E (0.61) KDM4EALDH1A1MAPTBLML3MBTL1
SCHEMBL29564333 0.74 KDM4E (0.61) KDM4EALDH1A1MAPTBLML3MBTL1
SCHEMBL3398695 0.72 KDM4E (0.44) KDM4EALDH1A1MAPTBLML3MBTL1

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-20100144760-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2010-06-10 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-20100144760-A1 NOVEL COMPOUNDS HTR3B, HTR1B, HTR2B KDM4E 1224/4885ALDH1A1 882/4885MAPT 2636/4885

“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.