SCHEMBL3249904

SCHEMBL3249904

CCOC(=O)c1c[nH]c2c(=O)[nH]c3ccc(-c4cccc(NC(=O)OC(C)(C)C)c4)cc3c12

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 18/20 0.44
JAK2 O60674 4/20 0.44
JAK1 P23458 1/20 0.42
CYP17A1 P05093 1/20 0.42

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
SCHEMBL3243050 0.92 MAP4K4 (0.41) JAK3JAK2CYP17A1
SCHEMBL3251493 0.89 CYP17A1 (0.45) JAK2CYP17A1
SCHEMBL3252021 0.89 JAK3 (0.47) JAK3JAK2JAK1
SCHEMBL3243042 0.87 CYP17A1 (0.41) JAK3JAK2CYP17A1
SCHEMBL3245835 0.86 TRPV1 (0.41) JAK3JAK2
SCHEMBL3251203 0.84 JAK3 (0.47) JAK3JAK2JAK1
SCHEMBL3252757 0.83 NPC1 (0.51) JAK3JAK2
SCHEMBL3250086 0.82 JAK2 (0.52) JAK3JAK2
SCHEMBL3254375 0.82 CYP17A1 (0.44) JAK2CYP17A1
SCHEMBL4155388 0.82 CYP17A1 (0.42) JAK2CYP17A1

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
EP-1899335-B1 PYRROLOQUINOLINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS PF MEDICAMENT (FR) 2010-05-19 EP claimed
US-8426437-B2 Pyrroloquinoline derivatives and their use as protein kinases inhibitors PIERRE FABRE MEDICAMENT (FR) 2013-04-23 US disclosed
US-8426437-B2 Pyrroloquinoline derivatives and their use as protein kinases inhibitors PIERRE FABRE MEDICAMENT (FR) 2013-04-23 US disclosed
US-20090042876-A1 Pyrroloquinoline Derivatives And Their Use As Protein Kinases Inhibitors PIERRE FABRE MEDICAMENT (FR) 2009-02-12 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-20090042876-A1 Pyrroloquinoline Derivatives And Their Use As Protein Kinases Inhibitors MAP3K1, MAP3K2, MAP3K7 JAK3 171/4885JAK2 70/4885JAK1 136/4885

“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.