SCHEMBL1355069

SCHEMBL1355069

COCC(=O)Nc1ccc(Nc2ncc3cnn(-c4ccc(OC)cc4)c3n2)cc1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EIF2AK4 Q9P2K8 2/20 0.61
FLT3 P36888 10/20 0.56
TBK1 Q9UHD2 1/20 0.49
EGFR P00533 6/20 0.48
BLK P51451 3/20 0.48
CDK4 P11802 1/20 0.48
CCND1 P24385 1/20 0.48
CCND2 P30279 1/20 0.48
CCND3 P30281 1/20 0.48
GSK3A P49840 2/20 0.46
GSK3B P49841 2/20 0.46
MALT1 Q9UDY8 1/20 0.45
MAPT P10636 2/20 0.44
CCNT1 O60563 1/20 0.44
CCNE1 P24864 1/20 0.44
CDK2 P24941 1/20 0.44
CDK9 P50750 1/20 0.44
AURKA O14965 1/20 0.44

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
SCHEMBL1356722 0.92 EIF2AK4 (0.56) EIF2AK4FLT3TBK1EGFRBLK
SCHEMBL1355573 0.90 EIF2AK4 (0.61) EIF2AK4FLT3TBK1EGFRBLK
SCHEMBL1356216 0.89 EIF2AK4 (0.59) EIF2AK4FLT3TBK1EGFRBLK
SCHEMBL1355646 0.88 FLT3 (0.64) EIF2AK4FLT3TBK1EGFRBLK
SCHEMBL1356787 0.86 EIF2AK4 (0.60) EIF2AK4FLT3TBK1EGFRBLK
SCHEMBL1355884 0.84 EIF2AK4 (0.60) EIF2AK4FLT3TBK1EGFRBLK
SCHEMBL1353786 0.84 EIF2AK4 (0.62) EIF2AK4FLT3TBK1EGFRBLK
SCHEMBL1356007 0.83 EIF2AK4 (0.67) EIF2AK4FLT3TBK1EGFRBLK
SCHEMBL1355579 0.83 EIF2AK4 (0.56) EIF2AK4FLT3TBK1EGFRBLK
SCHEMBL1356186 0.81 EIF2AK4 (0.67) EIF2AK4FLT3TBK1EGFRBLK

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-20110281821-A9 Modulators of Mitotic Kinases BIOGEN IDEC MA INC. (US) 2011-11-17 US claimed
US-20100249067-A1 Modulators of Mitotic Kinases BIOGEN IDEC MA INC. (US) 2010-09-30 US claimed
US-20110281821-A9 Modulators of Mitotic Kinases BIOGEN IDEC MA INC. (US) 2011-11-17 US disclosed
US-20100249067-A1 Modulators of Mitotic Kinases BIOGEN IDEC MA INC. (US) 2010-09-30 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 (2 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-20100249067-A1 Modulators of Mitotic Kinases BUB1, BUB1B, CDK1 EIF2AK4 791/4885FLT3 766/4885TBK1 1295/4885
US-20110281821-A9 Modulators of Mitotic Kinases BUB1, BUB1B, CDK1 EIF2AK4 791/4885FLT3 766/4885TBK1 1295/4885

“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.