SCHEMBL3264079

SCHEMBL3264079

COc1ccn2ncc(-c3nc4c(cc3F)c(NC(=O)c3c(F)cccc3F)nn4CCOC(C)=O)c2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 8/20 0.39
KDM4E B2RXH2 6/20 0.39
MAPK1 P28482 5/20 0.39
ALDH1A1 P00352 3/20 0.39
HPGD P15428 3/20 0.39
CASP1 P29466 3/20 0.39
CASP7 P55210 3/20 0.39
HSD17B10 Q99714 3/20 0.39
TDP1 Q9NUW8 3/20 0.39
GSK3A P49840 3/20 0.39
GSK3B P49841 3/20 0.39
ALOX15 P16050 2/20 0.39
TP53 P04637 2/20 0.39
MAPT P10636 3/20 0.38
NPSR1 Q6W5P4 3/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
LMNA P02545 2/20 0.38
TSHR P16473 2/20 0.38
EPHB3 P54753 1/20 0.37
CDK5 Q00535 2/20 0.37

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
SCHEMBL3107285 0.92 KDM4E (0.39) ATMKDM4EMAPK1ALDH1A1HPGD
SCHEMBL3264260 0.90 EPHB3 (0.41) ATMKDM4EMAPK1ALDH1A1HPGD
SCHEMBL3263319 0.89 EPHB3 (0.38) ATMKDM4EMAPK1ALDH1A1HPGD
SCHEMBL13099802 0.85 ALDH1A1 (0.39) ATMKDM4EMAPK1ALDH1A1HPGD
SCHEMBL3233849 0.85 KDM4E (0.35) KDM4EMAPK1ALDH1A1HPGDTP53
SCHEMBL3235770 0.84 SMN1; SMN2 (0.39) ATMKDM4EMAPK1ALDH1A1HPGD
SCHEMBL13099805 0.83 LMNA (0.42) KDM4EALDH1A1HPGDTDP1TP53
SCHEMBL8031085 0.83 ALDH1A1 (0.46) ATMKDM4EMAPK1ALDH1A1HPGD
SCHEMBL3237824 0.83 ATM (0.41) ATMKDM4EMAPK1ALDH1A1HPGD
SCHEMBL8049800 0.82 KDM4E (0.42) ATMKDM4EMAPK1ALDH1A1HPGD

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100256133-A1 NOVEL COMPOUNDS HAVING INDAZOLE FRAMEWORKS, METHODS FOR PREPARING THE SAME AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME CHOONGWAE PHARMA CORPORATION (KR) 2010-10-07 US disclosed
US-20100256133-A1 NOVEL COMPOUNDS HAVING INDAZOLE FRAMEWORKS, METHODS FOR PREPARING THE SAME AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME CHOONGWAE PHARMA CORPORATION (KR) 2010-10-07 US disclosed
US-20100256133-A1 NOVEL COMPOUNDS HAVING INDAZOLE FRAMEWORKS, METHODS FOR PREPARING THE SAME AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME CHOONGWAE PHARMA CORPORATION (KR) 2010-10-07 US disclosed
WO-2009038385-A2 NOVEL COMPOUNDS HAVING INDAZOLE FRAMEWORKS, METHODS FOR PREPARING THE SAME AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME CHOONGWAE PHARMA CORPORATION (KR) 2009-03-26 WO 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-20100256133-A1 NOVEL COMPOUNDS HAVING INDAZOLE FRAMEWORKS, METHODS FOR PREPARING THE SAME AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME MAP3K20, MAP3K3, MAP3K1 ATM 478/4885KDM4E 1683/4885MAPK1 164/4885

“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.