SCHEMBL6920482

SCHEMBL6920482

Cc1cn(-c2ncc(C(=O)NCC3(c4ccc(F)cc4)CC3)cc2Cl)cn1

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 18/20 0.43
MAPK1 P28482 1/20 0.41
P2RY12 Q9H244 1/20 0.39

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
SCHEMBL11902113 0.93 P2RX7 (0.44) P2RX7
SCHEMBL11902167 0.88 PSEN1 (0.46) P2RX7MAPK1
SCHEMBL11902417 0.85 MAPK1 (0.43) P2RX7MAPK1
SCHEMBL11901567 0.80 MAPK1 (0.43) P2RX7MAPK1
SCHEMBL11902750 0.79 MAPK1 (0.42) P2RX7MAPK1
SCHEMBL11902884 0.79 P2RX7 (0.40) P2RX7MAPK1
SCHEMBL11902390 0.77 MAPK1 (0.42) P2RX7MAPK1
SCHEMBL11902154 0.76 MAPK1 (0.40) P2RX7MAPK1
SCHEMBL11902403 0.76 P2RX7 (0.38) P2RX7MAPK1
SCHEMBL759651 0.74 PSEN1 (0.60)

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
US-20120202787-A1 Novel Heteroaryl Imidazoles And Heteroaryl Triazoles As Gamma-Secretase Modulators PFIZER INC. 2012-08-09 US disclosed
US-20120202787-A1 Novel Heteroaryl Imidazoles And Heteroaryl Triazoles As Gamma-Secretase Modulators PFIZER INC. 2012-08-09 US disclosed
US-20120202787-A1 Novel Heteroaryl Imidazoles And Heteroaryl Triazoles As Gamma-Secretase Modulators PFIZER INC. 2012-08-09 US disclosed
WO-2011048525-A1 NOVEL HETEROARYL IMIDAZOLES AND HETEROARYL TRIAZOLES AS GAMMA-SECRETASE MODULATORS PFIZER INC. (US) 2011-04-28 WO 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-20120202787-A1 Novel Heteroaryl Imidazoles And Heteroaryl Triazoles As Gamma-Secretase Modulators BACE1, BACE2, GSAP P2RX7 2079/4885MAPK1 3698/4885P2RY12 2042/4885

“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.