SCHEMBL3708155

SCHEMBL3708155

CC(C)(C)OC(=O)n1cc(Cn2ccc3c(NC(=O)Nc4ccc(OC(F)(F)F)cc4)cccc32)c2cccnc21

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
P2RY1 P47900 20/20 0.44
P2RY14 Q15391 2/20 0.44
P2RY2 P41231 1/20 0.42
KCNH2 Q12809 2/20 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
SCHEMBL3704782 0.90 ELANE (0.42) P2RY1
SCHEMBL3702550 0.86 PTGER3 (0.47)
SCHEMBL3702005 0.85 PTGER3 (0.44)
SCHEMBL3710717 0.84 PTGER3 (0.41)
SCHEMBL3712537 0.84 MEN1 (0.46)
SCHEMBL3704487 0.82 TRPV1 (0.42) P2RY1
SCHEMBL3703952 0.81 NTRK1 (0.53) P2RY1P2RY14P2RY2
SCHEMBL4569777 0.81 AKT1 (0.38) P2RY1
SCHEMBL3701028 0.81 FPR2 (0.41)
Hydrochloric Acid SCHEMBL3705741 0.81 NTRK1 (0.53) P2RY1P2RY14P2RY2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8648086-B2 5,6-bicyclic heteroaryl-containing urea compounds as kinase inhibitors ASCEPION PHARMACEUTICALS, INC. (CN) 2014-02-11 US disclosed
US-20120122895-A1 5,6-BICYCLIC HETEROARYL-CONTAINING UREA COMPOUNDS AS KINASE INHIBITORS JIANG, SHAN 2012-05-17 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-20120122895-A1 5,6-BICYCLIC HETEROARYL-CONTAINING UREA COMPOUNDS AS KINASE INHIBITORS FLT3, CSF1R, EPHA2 P2RY1 441/4885P2RY14 987/4885P2RY2 532/4885

“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.