SCHEMBL1220913

SCHEMBL1220913

COc1cc(Nc2nc(N)c(F)c(-c3cccc(C)c3N)n2)cc(OC)c1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 3/20 0.46
▸ AURKA O14965 1/20 0.46
▸ AURKB Q96GD4 1/20 0.46
▸ MEN1 O00255 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ MAPT P10636 3/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ POLB P06746 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ USP2 O75604 1/20 0.43
▸ FLT3 P36888 2/20 0.43
▸ PTK2 Q05397 4/20 0.42
▸ TP53 P04637 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ ALOX12 P18054 1/20 0.42
▸ RPS6KA2 Q15349 3/20 0.41
▸ RAD52 P43351 1/20 0.41
▸ BRAF P15056 1/20 0.41

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
SCHEMBL1038450 0.86 KDR (0.48) KDRAURKAAURKBMEN1KMT2A
SCHEMBL1039755 0.81 MEN1 (0.50) KDRAURKAAURKBMEN1KMT2A
SCHEMBL1222450 0.80 AURKA (0.51) KDRAURKAAURKBMEN1KMT2A
SCHEMBL12882101 0.71 SYK (0.61) KDRAURKAAURKBFLT3PTK2
SCHEMBL29436275 0.71 KDR (0.44) KDRAURKAAURKBMEN1KMT2A
Calcium SCHEMBL29436268 0.70 KDR (0.43) KDRAURKAAURKBMEN1KMT2A
SCHEMBL13955883 0.69 IGF1R (0.59) KDRAURKAAURKBPOLBFLT3
SCHEMBL4473977 0.68 KDR (0.70) KDRAURKAAURKBPTK2PLK1
SCHEMBL29430427 0.68 KDR (0.70) KDRAURKAAURKBPTK2PLK1
SCHEMBL5741810 0.67 ZAP70 (0.65) KDRAURKAAURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110028405-A1 SULFAMIDES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2011-02-03 — — US disclosed
EP-2234986-A2 SULFAMIDES AS ZAP-70 INHIBITORS Cellzome Limited (GB) 2010-10-06 — — EP disclosed
WO-2009080638-A2 SULFAMIDES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2009-07-02 — — 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-20110028405-A1 SULFAMIDES AS ZAP-70 INHIBITORS ZAP70, SYK, LCK KDR 4181/4885AURKA 3725/4885AURKB 3812/4885

“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.

Send feedback