SCHEMBL2510563

SCHEMBL2510563

CCCCN1Cc2cc(NCc3c(Cl)ccnc3Cl)ccc2C1=O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
CCR2 P41597 6/20 0.37
CRBN Q96SW2 1/20 0.37
PRF1 P14222 1/20 0.36
BCL6 P41182 1/20 0.35
TP53 P04637 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
THRB P10828 1/20 0.35
GRM5 P41594 2/20 0.35
GRM1 Q13255 2/20 0.34
LIPG Q9Y5X9 1/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
MET P08581 1/20 0.32

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
SCHEMBL2511407 0.91 HDAC6 (0.41) IDH1HDAC6CCR2CRBNPRF1
SCHEMBL2511462 0.88 CRBN (0.36) IDH1HDAC6CCR2CRBNPRF1
SCHEMBL2513409 0.85 HDAC6 (0.39) IDH1HDAC6CCR2CRBNPRF1
SCHEMBL2509909 0.84 GAA (0.41) IDH1HDAC6CCR2CRBNPRF1
SCHEMBL2505866 0.78 HDAC6 (0.45) IDH1HDAC6CCR2PRF1BCL6
SCHEMBL2512874 0.78 HDAC6 (0.39) IDH1HDAC6CRBNPRF1TP53
SCHEMBL2511082 0.77 PIK3CA (0.41) IDH1HDAC6CCR2GAAKDM4E
SCHEMBL18668940 0.76 ALDH1A1 (0.39) HDAC6TP53GAAMAPTTHRB
SCHEMBL2509721 0.76 HTR4 (0.37) IDH1HDAC6CRBNPRF1TP53
SCHEMBL2507370 0.76 IDH1 (0.33) IDH1CCR2BCL6LIPG

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 IDH1 1460/4885HDAC6 2366/4885CCR2 221/4885

“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.