SCHEMBL2504281

SCHEMBL2504281

CCCCN1Cc2cc(Nc3cncc(N4CCN(C)CC4)c3)ccc2C1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.42
DRD2 P14416 3/20 0.39
DRD5 P21918 3/20 0.39
DRD3 P35462 3/20 0.39
HTR1A P08908 1/20 0.39
HTR7 P34969 1/20 0.39
ADRA2A P08913 1/20 0.38
ADRA2C P18825 1/20 0.38
JAK2 O60674 1/20 0.38
JAK3 P52333 1/20 0.38
PTK2 Q05397 1/20 0.38
HRH4 Q9H3N8 1/20 0.38
CHRNB4 P30926 2/20 0.37
CHRNA3 P32297 2/20 0.37
GRM5 P41594 1/20 0.37
PRF1 P14222 1/20 0.36
CYP11B2 P19099 1/20 0.36
CCR2 P41597 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNA4 P43681 1/20 0.35

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
SCHEMBL2509330 0.92 HDAC6 (0.40) HDAC6DRD2DRD5DRD3HTR1A
SCHEMBL2509389 0.92 PIK3CA (0.44) HDAC6DRD2DRD5DRD3HTR1A
SCHEMBL2509397 0.84 HDAC6 (0.44) HDAC6DRD2DRD5DRD3GRM5
SCHEMBL2505984 0.83 HDAC6 (0.40) HDAC6DRD2DRD5DRD3HTR1A
SCHEMBL2508327 0.81 HDAC6 (0.44) HDAC6GRM5PRF1
SCHEMBL2510813 0.76 BRD9 (0.40) HDAC6DRD2DRD5DRD3HTR7
SCHEMBL2509402 0.75 CCNT1 (0.39) HDAC6DRD2DRD5DRD3HRH4
SCHEMBL2504269 0.75 HDAC6 (0.44) HDAC6GRM5
SCHEMBL2505706 0.73 HDAC6 (0.42) HDAC6GRM5PRF1
SCHEMBL2503427 0.72 HDAC6 (0.43) HDAC6GRM5PRF1

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-8314120-B2 Small molecule potentiators of metabotropic glutamate receptors ABBOTT GMBH & CO. KG (DE) 2012-11-20 US claimed
US-8314120-B2 Small molecule potentiators of metabotropic glutamate receptors ABBOTT GMBH & CO. KG (DE) 2012-11-20 US disclosed
US-20110245247-A1 NOVEL SMALL MOLECULE POTENTIATORS OF METABOTROPIC GLUTAMATE RECEPTORS 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-20110245247-A1 NOVEL SMALL MOLECULE POTENTIATORS OF METABOTROPIC GLUTAMATE RECEPTORS GRIN2C, GRM3, GRM2 HDAC6 2622/4885DRD2 218/4885DRD5 687/4885

“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.