SCHEMBL1355646

SCHEMBL1355646

COc1ccc(-n2ncc3cnc(Nc4ccc(NC(C)=O)cc4)nc32)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 11/20 0.64
EIF2AK4 Q9P2K8 2/20 0.62
EGFR P00533 6/20 0.51
BLK P51451 3/20 0.51
SLC2A1 P11166 1/20 0.50
TBK1 Q9UHD2 1/20 0.50
CDK4 P11802 1/20 0.48
CCND1 P24385 1/20 0.48
CCND2 P30279 1/20 0.48
CCND3 P30281 1/20 0.48
JAK1 P23458 1/20 0.48
CYP3A4 P08684 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
CYP2C9 P11712 2/20 0.47
KDM4E B2RXH2 1/20 0.47
NPC1 O15118 1/20 0.47
POLB P06746 1/20 0.47
MAPT P10636 1/20 0.47
HPGD P15428 1/20 0.47

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
SCHEMBL1356787 0.90 EIF2AK4 (0.60) FLT3EIF2AK4EGFRBLKTBK1
SCHEMBL1355573 0.88 EIF2AK4 (0.61) FLT3EIF2AK4EGFRBLKTBK1
SCHEMBL1355069 0.88 EIF2AK4 (0.61) FLT3EIF2AK4EGFRBLKTBK1
SCHEMBL1353786 0.87 EIF2AK4 (0.62) FLT3EIF2AK4EGFRBLKTBK1
SCHEMBL27766949 0.87 MEN1 (0.51) FLT3EIF2AK4EGFRCYP3A4MEN1
SCHEMBL1356007 0.87 EIF2AK4 (0.67) FLT3EIF2AK4EGFRBLKTBK1
SCHEMBL1355579 0.86 EIF2AK4 (0.56) FLT3EIF2AK4EGFRBLKTBK1
SCHEMBL1356216 0.86 EIF2AK4 (0.59) FLT3EIF2AK4EGFRBLKTBK1
SCHEMBL1355884 0.85 EIF2AK4 (0.60) FLT3EIF2AK4EGFRBLKTBK1
SCHEMBL1356186 0.84 EIF2AK4 (0.67) FLT3EIF2AK4EGFRBLKTBK1

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 6 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
EP-2108020-A2 1-H-PYRAZOLO[3,4B]PYRIMIDINE DERIVATIVES AND THEIR USE AS MODULATORS OF MITOTIC KINASES Biogen Idec MA, Inc. (US) 2009-10-14 EP claimed
WO-2008094602-A2 1-H-PYRAZOLO (3,4B) PYRIMIDINE DERIVATIVES AND THEIR USE AS MODULATORS OF MITOTIC KINASES BIOGEN IDEC MA INC. (US) 2008-08-07 WO 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 FLT3 766/4885EIF2AK4 791/4885EGFR 1291/4885
US-20110281821-A9 Modulators of Mitotic Kinases BUB1, BUB1B, CDK1 FLT3 766/4885EIF2AK4 791/4885EGFR 1291/4885

“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.