SCHEMBL2508796

SCHEMBL2508796

Cc1cc(NCc2c(C(F)(F)F)ccnc2Cl)cc2c1C(=O)N(CC(F)(F)F)C2

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 2/20 0.45
P2RX7 Q99572 1/20 0.32
WDR5 P61964 1/20 0.31
KMT2A Q03164 1/20 0.31
SIK2 Q9H0K1 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
SCHEMBL2510811 0.92 PIK3CG (0.37) PIK3CGP2RX7WDR5KMT2A
SCHEMBL2510495 0.90 PIK3CG (0.36) PIK3CGP2RX7WDR5KMT2A
SCHEMBL2511459 0.89 PIK3CG (0.35) PIK3CGP2RX7WDR5KMT2A
SCHEMBL2511909 0.88 ALDH1A1 (0.40) PIK3CGP2RX7
SCHEMBL2507370 0.80 IDH1 (0.33) WDR5KMT2A
SCHEMBL2511074 0.75 PARP1 (0.32) P2RX7
SCHEMBL2511462 0.74 CRBN (0.36) WDR5KMT2A
SCHEMBL2509719 0.73 IDH1 (0.36) P2RX7WDR5KMT2A
SCHEMBL2510491 0.70 PIK3CG (0.46) PIK3CGSIK2
SCHEMBL12442781 0.65 CHEK2 (0.42) PIK3CGKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8664214-B2 Small molecule potentiators of metabotropic glutamate receptors I AbbVie Deutschland GmbH & Co. KG (DE) 2014-03-04 US claimed
US-8664214-B2 Small molecule potentiators of metabotropic glutamate receptors I AbbVie Deutschland GmbH & Co. KG (DE) 2014-03-04 US disclosed
US-20110245232-A1 NOVEL SMALL MOLECULE POTENTIATORS OF METABOTROPIC GLUTAMATE RECEPTORS I ABBOTT GMBH & CO. KG (DE) 2011-10-06 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-20110245232-A1 NOVEL SMALL MOLECULE POTENTIATORS OF METABOTROPIC GLUTAMATE RECEPTORS I GRM3, GRIN2C, GRIN2B PIK3CG 3558/4885P2RX7 463/4885WDR5 3250/4885

“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.