SCHEMBL16570938

SCHEMBL16570938

FC(F)(F)c1cccc(Nc2cc3c(ccn3Cc3cccnc3)cn2)c1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 1/20 0.50
▸ AURKA O14965 5/20 0.47
▸ GRIN2B Q13224 4/20 0.46
▸ CTSC P53634 1/20 0.45
▸ GRIN1 Q05586 3/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ POLB P06746 1/20 0.44
▸ UBE2M P61081 2/20 0.43
▸ DCUN1D1 Q96GG9 2/20 0.43
▸ PTK2 Q05397 1/20 0.42
▸ PRKDC P78527 1/20 0.42
▸ THRB P10828 1/20 0.42
▸ GAA P10253 1/20 0.41
▸ NAMPT P43490 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
SCHEMBL16571113 0.82 PTK2 (0.44) AURKAGRIN2BPTK2GAA
SCHEMBL16332608 0.79 KIF11 (0.46) KIF11AURKAGRIN2BCTSCGRIN1
SCHEMBL16570655 0.77 PTK2 (0.43) PTK2NAMPT
SCHEMBL16570980 0.77 PTK2 (0.71) PTK2GAA
SCHEMBL16570521 0.76 PTK2 (0.41) AURKAGRIN2BPTK2NAMPT
SCHEMBL16570201 0.74 KIF11 (0.47) KIF11PTK2
SCHEMBL10558040 0.69 KIF11 (0.62) KIF11KDM4ENAMPT
SCHEMBL1607822 0.68 HDAC2 (0.47) GRIN2BPTK2
SCHEMBL3267001 0.67 KIF11 (0.51) KIF11AURKACTSCNAMPT
SCHEMBL10417635 0.67 KIF11 (0.60) KIF11AURKACTSCKDM4EPOLB

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-20160222014-A1 COMPOUNDS FOR REGULATING FAK AND/OR SRC PATHWAYS ASANA BIOSCIENCES, LLC (US) 2016-08-04 — — US claimed
WO-2015038417-A1 COMPOUNDS FOR REGULATING FAK AND/OR SRC PATHWAYS ASANA BIOSCIENCES, LLC (US) 2015-03-19 — — WO claimed
US-20160222014-A1 COMPOUNDS FOR REGULATING FAK AND/OR SRC PATHWAYS ASANA BIOSCIENCES, LLC (US) 2016-08-04 — — US disclosed
WO-2015038417-A1 COMPOUNDS FOR REGULATING FAK AND/OR SRC PATHWAYS ASANA BIOSCIENCES, LLC (US) 2015-03-19 — — 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-20160222014-A1 COMPOUNDS FOR REGULATING FAK AND/OR SRC PATHWAYS SRC, PTK2, FYN KIF11 3206/4885AURKA 812/4885GRIN2B 3041/4885

“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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