SCHEMBL14701603

SCHEMBL14701603

CC(C)c1cn2cc(F)cnc2n1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 19/20 0.33
KDM5B Q9UGL1 1/20 0.32

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
SCHEMBL798899 0.81 KDM5B (0.33) GRM5KDM5B
SCHEMBL14701602 0.80 KDM5B (0.33) KDM5B
SCHEMBL14701746 0.79 KDM5B (0.32) GRM5KDM5B
SCHEMBL12443626 0.76 GRM5 (0.39) GRM5
SCHEMBL23571869 0.73 GPR139 (0.31)
SCHEMBL12197120 0.69 APP (0.46) GRM5
SCHEMBL12196880 0.69 ALDH1A1 (0.49)
SCHEMBL23571867 0.68 CDK4 (0.32) GRM5
SCHEMBL2326296 0.68 PTGS1 (0.41) GRM5
SCHEMBL23572001 0.67 KDM5B (0.30) KDM5B

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-9284350-B2 IAP BIR domain binding compounds PHARMASCIENCE INC. (CA) 2016-03-15 US disclosed
US-20130040892-A1 IAP BIR DOMAIN BINDING COMPOUNDS PHARMASCIENCE INC. (CA) 2013-02-14 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-20130040892-A1 IAP BIR DOMAIN BINDING COMPOUNDS BIRC5, BIRC2, BIRC3 GRM5 4825/4885KDM5B 3284/4885

“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.