SCHEMBL3704487

SCHEMBL3704487

CC(C)(C)OC(=O)n1ccc2c(Cn3ccc4c(NC(=O)Nc5ccc(C(F)(F)F)cc5)cccc43)ccnc21

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 3/20 0.42
MAPT P10636 3/20 0.41
P2RY1 P47900 10/20 0.41
MEN1 O00255 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
BRAF P15056 1/20 0.38
GSK3A P49840 1/20 0.36
GSK3B P49841 1/20 0.36
FPR2 P25090 1/20 0.36
AKT1 P31749 1/20 0.36

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
SCHEMBL4569777 0.91 AKT1 (0.38) MAPTP2RY1MEN1RAB9AKMT2A
SCHEMBL3701028 0.91 FPR2 (0.41) MAPTMEN1HTTRAB9AKMT2A
SCHEMBL3708155 0.82 P2RY1 (0.44) P2RY1
SCHEMBL3704782 0.82 ELANE (0.42) MAPTP2RY1MEN1KMT2AAKT1
SCHEMBL3701869 0.81 IGF1R (0.41) MAPTMEN1KMT2A
SCHEMBL3703821 0.80 TRPV1 (0.48) TRPV1MAPTP2RY1MEN1HTT
Hydrochloric Acid SCHEMBL3703864 0.80 TRPV1 (0.47) TRPV1MAPTP2RY1MEN1HTT
SCHEMBL3698821 0.80 L3MBTL1 (0.36) AKT1
SCHEMBL3702005 0.78 PTGER3 (0.44) TRPV1MAPTRAB9AAKT1
SCHEMBL3702550 0.77 PTGER3 (0.47) TRPV1MAPTMEN1RAB9AKMT2A

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 TRPV1 4841/4885MAPT 2492/4885P2RY1 441/4885

“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.