SCHEMBL4012901

SCHEMBL4012901

Cc1ccc(C(=O)OC[C@H]2O[C@@H](n3c(Br)c(C#N)c4c(N)ncnc43)[C@](C)(OC(=O)c3ccc(C)cc3)[C@@H]2OC(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 2/20 0.38
▸ KDR P35968 2/20 0.38
▸ ABL1 P00519 1/20 0.38
▸ YES1 P07947 1/20 0.38
▸ LYN P07948 1/20 0.38
▸ FGFR3 P22607 1/20 0.38
▸ DYRK1A Q13627 1/20 0.36
▸ CCNA2 P20248 3/20 0.36
▸ CDK2 P24941 3/20 0.36
▸ CCNA1 P78396 3/20 0.36
▸ CDK5 Q00535 1/20 0.36
▸ CDK5R1 Q15078 1/20 0.36
▸ HSPA8 P11142 2/20 0.35
▸ ABCB1 P08183 1/20 0.35
▸ HSPA2 P54652 2/20 0.35
▸ EGFR P00533 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ GSK3A P49840 1/20 0.33
▸ RPS6KA3 P51812 1/20 0.33
▸ MAPK14 Q16539 1/20 0.33

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
SCHEMBL13064458 0.93 HSPA8 (0.37) SRCKDRDYRK1ACCNA2CDK2
SCHEMBL2786518 0.93 HSPA8 (0.37) SRCKDRDYRK1ACCNA2CDK2
SCHEMBL2786030 0.84 HSPA8 (0.38) SRCKDRDYRK1ACCNA2CDK2
SCHEMBL2786035 0.84 HSPA8 (0.38) SRCKDRDYRK1ACCNA2CDK2
SCHEMBL4014365 0.84 ADK (0.41) SRCKDRABL1YES1LYN
SCHEMBL13021272 0.81 SRC (0.37) SRCKDRABL1YES1LYN
SCHEMBL12451475 0.79 HSPA8 (0.39) SRCKDRDYRK1ACCNA2CDK2
SCHEMBL2786054 0.77 ADK (0.42) SRCKDRABCB1EGFRGSK3A
SCHEMBL13064459 0.77 ADK (0.42) SRCKDRABCB1EGFRGSK3A
SCHEMBL13005503 0.74 ATG7 (0.40) SRCKDRABL1YES1LYN

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-20090253648-A1 Tricyclic-Nucleoside Compounds for Treating Viral Infections SMITHKLINE BEECHAM CORPORATION (US) 2009-10-08 — — US disclosed
US-7524825-B2 Tricyclic-nucleoside compounds for treating viral infections SMITHKLINE BEECHAM CORPORATION (US) 2009-04-28 — — US disclosed
US-20090048189-A1 TRICYCLIC-NUCLEOSIDE COMPOUNDS FOR TREATING VIRAL INFECTIONS GENELABS TECHNOLOGIES, INC. 2009-02-19 — — US disclosed
US-20060252715-A1 Tricyclic-nucleoside compounds for treating viral infections GENELABS TECHNOLOGIES, INC. 2006-11-09 — — 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 (3 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-20090048189-A1 TRICYCLIC-NUCLEOSIDE COMPOUNDS FOR TREATING VIRAL INFECTIONS TYMP, PNP, NSUN2 SRC 4730/4885KDR 3403/4885ABL1 1971/4885
US-20060252715-A1 Tricyclic-nucleoside compounds for treating viral infections PNP, TYMP, NSUN2 SRC 4610/4885KDR 2455/4885ABL1 1466/4885
US-20090253648-A1 Tricyclic-Nucleoside Compounds for Treating Viral Infections PNP, TYMP, NSUN2 SRC 4610/4885KDR 2455/4885ABL1 1466/4885

“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.

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