SCHEMBL3316358

SCHEMBL3316358

COc1cc(OC)c(F)c(-c2ccc(C(=O)O)c3nccnc23)c1F.Nc1ccc(Cn2ccnc2)cn1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 16/20 0.51
CYP11B1 P15538 1/20 0.44
CYP11B2 P19099 1/20 0.44
TBXAS1 P24557 1/20 0.41
CYP19A1 P11511 1/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL3313709 0.95 FGFR3 (0.54) FGFR3CYP11B1CYP11B2
SCHEMBL3316356 0.91 FGFR3 (0.50) FGFR3CYP11B1CYP11B2TBXAS1
SCHEMBL3313560 0.91 FGFR3 (0.51) FGFR3CYP11B1CYP11B2
SCHEMBL3313707 0.88 FGFR3 (0.54) FGFR3CYP11B1CYP11B2
SCHEMBL1126473 0.84 FGFR3 (0.72) FGFR3
SCHEMBL3314125 0.83 FGFR3 (0.72) FGFR3
SCHEMBL3313556 0.82 FGFR3 (0.51) FGFR3CYP11B1CYP11B2
SCHEMBL3318311 0.80 FGFR3 (0.73) FGFR3
SCHEMBL17023170 0.80 FGFR3 (0.56) FGFR3CYP11B1CYP11B2ALDH1A1
SCHEMBL3317627 0.80 FGFR3 (0.60) FGFR3

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-20100105667-A1 Quinoxaline- and Quinoline-Carboxamide Derivatives NOVARTIS AG 2010-04-29 US claimed

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-20100105667-A1 Quinoxaline- and Quinoline-Carboxamide Derivatives ABL1, NQO2, MAP4K5 FGFR3 1515/4885CYP11B1 510/4885CYP11B2 366/4885

“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.