SCHEMBL6506433

SCHEMBL6506433

CCN(Cc1cncc(-c2ccc3c(c2)c(-c2nc(-c4cccc(C(F)(F)F)c4)c(C)[nH]2)nn3C2CCCCO2)c1C)C(=O)OC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 1/20 0.35
DDR2 Q16832 1/20 0.35
PTGDR2 Q9Y5Y4 10/20 0.34
MAP3K8 P41279 1/20 0.34
ATR Q13535 2/20 0.33
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32
KRAS P01116 1/20 0.31
MAP2K4 P45985 1/20 0.31

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
SCHEMBL6508509 0.94 PTGDR2 (0.35) FGFR1DDR2PTGDR2MAP3K8KRAS
SCHEMBL6507148 0.93 MAP3K8 (0.40) MAP3K8ATRKRAS
SCHEMBL6503910 0.89 MAP3K8 (0.33) FGFR1DDR2PTGDR2MAP3K8KRAS
SCHEMBL6506250 0.89 KRAS (0.34) PTGDR2MAP3K8KRAS
SCHEMBL6502580 0.89 KRAS (0.33) MAP3K8ATRKRAS
SCHEMBL6504036 0.88 MAP3K8 (0.33) MAP3K8ATRKRAS
SCHEMBL6500744 0.87 MAP3K8 (0.34) MAP3K8KRAS
SCHEMBL6502627 0.86 MAP3K8 (0.35) MAP3K8KRAS
SCHEMBL6504135 0.86 MAP3K8 (0.33) MAP3K8
SCHEMBL6510542 0.86 MAP3K8 (0.36) MAP3K8ATRKRAS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050090529-A1 3,5 Disubstituted indazole compounds with nitrogen-bearing 5-membered heterocycles, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation PFIZER INC 2005-04-28 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 (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-20050090529-A1 3,5 Disubstituted indazole compounds with nitrogen-bearing 5-membered heterocycles, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation CDK3, CDK4, CDK9 FGFR1 225/4885DDR2 2394/4885PTGDR2 649/4885

“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.