SCHEMBL657180

SCHEMBL657180

O=C1CC(c2ccc(Cl)c(F)c2)CC(=O)O1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 13/20 0.38
SLC6A4 P31645 11/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SLC6A3 Q01959 9/20 0.37
SIRT2 Q8IXJ6 2/20 0.37
HTR7 P34969 1/20 0.37
THRB P10828 1/20 0.37
CTRB1 P17538 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL31560348 1.00 SLC6A2 (0.38) SLC6A2SLC6A4MEN1KMT2ASLC6A3
SCHEMBL6048200 0.84 SIRT2 (0.45) SIRT2CTRB1
SCHEMBL657183 0.84 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3THRBCTRB1
SCHEMBL31560332 0.81 RIPK1 (0.36) SLC6A2SLC6A4SLC6A3HTR7
SCHEMBL5422791 0.81 MAPT (0.47) SLC6A2SLC6A4KMT2ASLC6A3HTR7
SCHEMBL657118 0.80 ABCC9 (0.40)
SCHEMBL12371068 0.79 PIM1 (0.35) SLC6A2SLC6A4SLC6A3HTR7
SCHEMBL31560367 0.77 CTRB1 (0.38) SIRT2CTRB1
SCHEMBL6261861 0.76 KDM1A (0.51)
SCHEMBL15517006 0.76 SLC6A3 (0.42) SLC6A2SLC6A4SLC6A3HTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2349999-B1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIV SAARLAND (DE) 2016-01-27 EP disclosed
US-8912186-B2 Allosteric protein kinase modulators UNIVERSITAET DES SAARLANDES (DE) 2014-12-16 US disclosed
US-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2012-02-23 US disclosed
EP-2349999-A1 ALLOSTERIC PROTEIN KINASE MODULATORS Universität des Saarlandes (DE) 2011-08-03 EP disclosed
WO-2010043711-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2010-04-22 WO disclosed
EP-2177510-A1 Allosteric protein kinase modulators Universität des Saarlandes (DE) 2010-04-21 EP 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-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS AURKC, AURKA, AURKB SLC6A2 4755/4885SLC6A4 4736/4885MEN1 2058/4885

“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.