SCHEMBL16570835

SCHEMBL16570835

Cc1nn(Cc2ccccc2OC(F)F)c2cc(Nc3ccc4c(c3)CCC(=O)N4)ncc12

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 8/20 0.42
▸ MAPK1 P28482 5/20 0.41
▸ PTK2 Q05397 1/20 0.39
▸ PTK2B Q14289 1/20 0.39
▸ ULK1 O75385 5/20 0.39
▸ CRBN Q96SW2 1/20 0.36

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
SCHEMBL16571010 0.85 KIF11 (0.43) KIF11MAPK1PTK2PTK2BULK1
SCHEMBL16570966 0.82 KIF11 (0.43) KIF11MAPK1PTK2PTK2BULK1
SCHEMBL16571152 0.80 MAPK1 (0.44) MAPK1
SCHEMBL16570815 0.80 KIF11 (0.43) KIF11MAPK1PTK2PTK2BULK1
SCHEMBL16571125 0.80 IRAK4 (0.41) MAPK1
SCHEMBL16570659 0.79 MAPK1 (0.45) MAPK1
SCHEMBL16570523 0.79 PTK2 (0.58) KIF11MAPK1PTK2PTK2B
SCHEMBL16570701 0.77 ULK1 (0.47) KIF11PTK2PTK2BULK1
SCHEMBL16570151 0.74 ULK1 (0.47) KIF11PTK2PTK2BULK1
SCHEMBL16570824 0.74 KIF11 (0.47) KIF11PTK2PTK2BULK1CRBN

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 5 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
US-20150175545-A1 Preparation Method of Fluoro-Substituted Deuterated Diphenylurea SUZHOU ZELGEN BIOPHARMACEUTICAL CO LTD (CN) 2015-06-25 — — 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 (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-20160222014-A1 COMPOUNDS FOR REGULATING FAK AND/OR SRC PATHWAYS SRC, PTK2, FYN KIF11 3206/4885MAPK1 96/4885PTK2 2/4885
US-20150175545-A1 Preparation Method of Fluoro-Substituted Deuterated Diphenylurea CCND3, UBE2D3, VDR KIF11 2130/4885MAPK1 4581/4885PTK2 4541/4885

“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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