SCHEMBL2509717

SCHEMBL2509717

CCCCN1Cc2cc(N(C)c3cnccc3NCc3ccccc3)ccc2C1=O

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 13/20 0.38
KDM6B O15054 11/20 0.38
GRM5 P41594 2/20 0.36
IDH1 O75874 1/20 0.36
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34
GRM1 Q13255 2/20 0.34
KDM4E B2RXH2 1/20 0.34
KDM4A O75164 1/20 0.34
KDM4D Q6B0I6 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPK10 P53779 1/20 0.34
PDE4B Q07343 1/20 0.33

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
SCHEMBL2507288 0.88 GRM5 (0.38) KDM4CKDM6BGRM5IDH1PTGS1
SCHEMBL2514237 0.84 GRM5 (0.40) KDM4CKDM6BGRM5IDH1GRM1
SCHEMBL2511391 0.81 GRM5 (0.38) KDM4CGRM5IDH1PTGS1PTGS2
SCHEMBL2509716 0.81 KDM4E (0.38) KDM4CKDM6BGRM5IDH1KDM4E
SCHEMBL2511387 0.81 PRF1 (0.36) KDM4CKDM6BGRM5IDH1GRM1
SCHEMBL2511617 0.79 PRF1 (0.37) KDM4CKDM6BGRM5IDH1GRM1
SCHEMBL2512031 0.75 PRF1 (0.38) GRM5GRM1KDM4EALDH1A1
SCHEMBL2506683 0.75 GRM5 (0.41) GRM5IDH1GRM1KDM4EALDH1A1
SCHEMBL2515759 0.74 MAPT (0.45) KDM4EALDH1A1
SCHEMBL2507290 0.73 HDAC6 (0.39) KDM4CKDM6BGRM5IDH1PTGS1

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 KDM4C 2588/4885KDM6B 3609/4885GRM5 17/4885

“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.