SCHEMBL3306433

SCHEMBL3306433

N#Cc1cnc(CN2CC(c3ccc(F)c(F)c3F)CC2=O)[nH]1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 3/20 0.36
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
GRM5 P41594 1/20 0.31
CXCR2 P25025 1/20 0.31
DPP4 P27487 1/20 0.31
CSF1R P07333 1/20 0.31
CALCRL Q16602 1/20 0.30

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
SCHEMBL2232281 0.83 PLA2G7 (0.39) PLA2G7HPGDTSHRCSF1R
SCHEMBL12471409 0.78 ALOX15 (0.37) HPGDTSHRGRM5
SCHEMBL5149265 0.73 HPGD (0.34) PLA2G7HPGDTSHRGRM5DPP4
SCHEMBL29868298 0.72 PLA2G7 (0.37) PLA2G7HPGDTSHR
SCHEMBL20555017 0.72 PLA2G7 (0.39) PLA2G7DPP4
SCHEMBL29868565 0.72 PLA2G7 (0.39) PLA2G7DPP4
SCHEMBL661007 0.72 PLA2G7 (0.37) PLA2G7HPGDTSHR
SCHEMBL660731 0.72 PLA2G7 (0.39) PLA2G7DPP4
SCHEMBL29868300 0.72 PLA2G7 (0.37) PLA2G7HPGDTSHR
SCHEMBL2948183 0.71 ALDH1A1 (0.37) PLA2G7HPGDTSHRGRM5CALCRL

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-20100099735-A1 METHODS AND COMPOSITIONS FOR IMPROVING COGNITIVE FUNCTION NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2010-04-22 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-20100099735-A1 METHODS AND COMPOSITIONS FOR IMPROVING COGNITIVE FUNCTION BACE2, RAB2A, VAMP8 PLA2G7 705/4885HPGD 3278/4885TSHR 3360/4885

“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.