SCHEMBL3703937

SCHEMBL3703937

NC(=O)[C@H]1CCC[C@H]1Nc1nc(Cl)nc2ccoc12

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDR P35968 3/20 0.42
AURKB Q96GD4 3/20 0.42
SYK P43405 1/20 0.36
IRAK4 Q9NWZ3 4/20 0.36
INSR P06213 2/20 0.35
ALK Q9UM73 2/20 0.35
CNR2 P34972 3/20 0.33
CNR1 P21554 1/20 0.33
P2RX7 Q99572 1/20 0.33
PSEN1 P49768 3/20 0.33
PSEN2 P49810 3/20 0.33
APH1B Q8WW43 3/20 0.33
NCSTN Q92542 3/20 0.33
APH1A Q96BI3 3/20 0.33
PSENEN Q9NZ42 3/20 0.33
GRM4 Q14833 1/20 0.31

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
SCHEMBL3703938 1.00 KDR (0.42) KDRAURKBSYKIRAK4INSR
SCHEMBL3703940 1.00 KDR (0.42) KDRAURKBSYKIRAK4INSR
SCHEMBL3712626 0.78 IRAK4 (0.44) KDRSYKIRAK4ALK
SCHEMBL3705205 0.77 SYK (0.48) KDRAURKBSYKIRAK4ALK
SCHEMBL1709800 0.75 IRAK4 (0.49) KDRSYKIRAK4ALK
SCHEMBL3706236 0.74 IRAK4 (0.35) KDRSYKIRAK4ALK
SCHEMBL20273951 0.74 KMT2A (0.47) KDRSYKIRAK4ALK
SCHEMBL2061141 0.73 KDR (0.62) KDRAURKBSYKINSRALK
SCHEMBL2061144 0.73 KDR (0.62) KDRAURKBSYKINSRALK
SCHEMBL2061143 0.73 KDR (0.62) KDRAURKBSYKINSRALK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8551981-B2 Furo[3,2-d]pyrimidine compounds ABBVIE INC. (US) 2013-10-08 US disclosed
US-20120122846-A1 FURO[3,2-d]PYRIMIDINE COMPOUNDS ABBOTT LABORATORIES (US) 2012-05-17 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-20120122846-A1 FURO[3,2-d]PYRIMIDINE COMPOUNDS CDK2, DPYD, CDK3 KDR 1487/4885AURKB 282/4885SYK 1176/4885

“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.