SCHEMBL1683383

SCHEMBL1683383

Cc1c(OCCN)cn2ncnc(Oc3cnc4[nH]ccc4c3F)c12

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 14/20 0.74
CYP3A4 P08684 11/20 0.48
KCNH2 Q12809 3/20 0.48
FGFR1 P11362 5/20 0.46
STK10 O94804 2/20 0.46
MAP4K4 O95819 2/20 0.46
RET P07949 2/20 0.46
PDGFRB P09619 2/20 0.46
DDR1 Q08345 2/20 0.46
SLK Q9H2G2 2/20 0.46
EPHB6 O15197 1/20 0.46
RIPK2 O43353 1/20 0.46
ABL1 P00519 1/20 0.46
EGFR P00533 1/20 0.46
LCK P06239 1/20 0.46
CSF1R P07333 1/20 0.46
HCK P08631 1/20 0.46
KIT P10721 1/20 0.46
SRC P12931 1/20 0.46
PDGFRA P16234 1/20 0.46

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
SCHEMBL1683392 0.87 KDR (0.83) KDRCYP3A4KCNH2FGFR1STK10
SCHEMBL1683441 0.87 KDR (0.67) KDRCYP3A4KCNH2FGFR1STK10
SCHEMBL1683393 0.86 KDR (0.68) KDRCYP3A4KCNH2FGFR1STK10
SCHEMBL1683408 0.85 KDR (0.72) KDRCYP3A4KCNH2FGFR1STK10
SCHEMBL1683394 0.85 KDR (1.00) KDRCYP3A4KCNH2FGFR1STK10
SCHEMBL1683435 0.85 KDR (1.00) KDRCYP3A4KCNH2FGFR1STK10
SCHEMBL1683397 0.85 KDR (1.00) KDRCYP3A4KCNH2FGFR1STK10
SCHEMBL1683463 0.85 KDR (0.82) KDRCYP3A4KCNH2FGFR1STK10
SCHEMBL1683465 0.85 KDR (0.82) KDRCYP3A4KCNH2FGFR1STK10
SCHEMBL1683460 0.85 KDR (0.82) KDRCYP3A4KCNH2FGFR1STK10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1539763-B1 AZAINDOLE KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2011-04-13 EP claimed
US-20060058304-A1 Azaindole kinase inhibitors BHIDE RAJEEV S 2006-03-16 US claimed
US-6969717-B2 Azaindole kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2005-11-29 US claimed
US-20040063707-A1 Azaindole kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2004-04-01 US claimed
EP-1539763-B1 AZAINDOLE KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2011-04-13 EP disclosed
US-20060058304-A1 Azaindole kinase inhibitors BHIDE RAJEEV S 2006-03-16 US disclosed
US-6969717-B2 Azaindole kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2005-11-29 US disclosed
US-20040063707-A1 Azaindole kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2004-04-01 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-20040063707-A1 Azaindole kinase inhibitors FGFR1, FGFR2, FLT1 KDR 5/4885CYP3A4 1437/4885KCNH2 3157/4885
US-20060058304-A1 Azaindole kinase inhibitors FGFR1, FGFR2, FLT1 KDR 5/4885CYP3A4 1479/4885KCNH2 3245/4885

“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.