SCHEMBL4065238

SCHEMBL4065238

COc1cc(-c2n[nH]c3cc(Oc4ccccc4F)ccc23)cc(OC)c1OC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 4/20 0.56
CCNA2 P20248 4/20 0.56
CCND1 P24385 4/20 0.56
CDK2 P24941 4/20 0.56
CCND3 P30281 4/20 0.56
KDR P35968 4/20 0.56
CHEK1 O14757 2/20 0.47
FGFR1 P11362 2/20 0.47
MAPK8 P45983 1/20 0.46
MAPK10 P53779 1/20 0.46
MAPK14 Q16539 1/20 0.46
MAP2K4 P45985 4/20 0.45
ITK Q08881 2/20 0.45
BRAF P15056 1/20 0.41
PDGFRB P09619 3/20 0.41
LRRK2 Q5S007 1/20 0.39
TUBB4A P04350 1/20 0.39
TUBB P07437 1/20 0.39
TUBA3C P0DPH7 1/20 0.39
TUBA1B P68363 1/20 0.39

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
SCHEMBL4065382 0.90 CDK4 (0.51) CDK4CCNA2CCND1CDK2CCND3
SCHEMBL4059067 0.88 MAP2K4 (0.50) CDK4CCNA2CCND1CDK2CCND3
SCHEMBL4068311 0.87 ITK (0.46) CDK4CCNA2CCND1CDK2CCND3
SCHEMBL4059673 0.85 MAP2K4 (0.62) CDK4CCNA2CCND1CDK2CCND3
SCHEMBL4060826 0.85 MAP2K4 (0.49) CDK4CCNA2CCND1CDK2CCND3
SCHEMBL4065232 0.84 MAP2K4 (0.48) CDK4CCNA2CCND1CDK2CCND3
SCHEMBL4060839 0.84 ITK (0.48) CDK4CCNA2CCND1CDK2CCND3
SCHEMBL4063919 0.83 MAP2K4 (0.50) CDK4CCNA2CCND1CDK2CCND3
SCHEMBL4058556 0.83 MAP2K4 (0.59) CDK4CCNA2CCND1CDK2CCND3
SCHEMBL4062435 0.81 NPC1 (0.42) CDK4CCNA2CCND1CDK2CCND3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7495015-B2 Indazole derivatives and methods for using the same ROCHE PALO ALTO LLC (US) 2009-02-24 US claimed
EP-1747202-A1 INDAZOLE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM F.HOFFMANN-LA ROCHE AG (CH) 2007-01-31 EP claimed
US-20050215595-A1 Indazole derivatives and methods for using the same ROCHE PALO ALTO LLC 2005-09-29 US claimed
WO-2005085206-A1 INDAZOLE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM F. HOFFMANN-LA ROCHE AG (CH) 2005-09-15 WO claimed
US-7495015-B2 Indazole derivatives and methods for using the same ROCHE PALO ALTO LLC (US) 2009-02-24 US disclosed
US-7495015-B2 Indazole derivatives and methods for using the same ROCHE PALO ALTO LLC (US) 2009-02-24 US disclosed
US-7495015-B2 Indazole derivatives and methods for using the same ROCHE PALO ALTO LLC (US) 2009-02-24 US disclosed
EP-1747202-A1 INDAZOLE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM F.HOFFMANN-LA ROCHE AG (CH) 2007-01-31 EP disclosed
US-20050215595-A1 Indazole derivatives and methods for using the same ROCHE PALO ALTO LLC 2005-09-29 US disclosed
WO-2005085206-A1 INDAZOLE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM F. HOFFMANN-LA ROCHE AG (CH) 2005-09-15 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-20050215595-A1 Indazole derivatives and methods for using the same MAPK1, MAP3K1, MAP3K7 CDK4 452/4885CCNA2 1333/4885CCND1 1280/4885

“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.