SCHEMBL4022270

SCHEMBL4022270

COCCNc1c(Cl)cccc1C(=O)[C@H]1CN(CCOC)C[C@H](C(=O)c2cccc(OC)c2)[C@@H]1c1cccc(F)c1C

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM2B Q8NHM5 4/20 0.39
DRD4 P21917 6/20 0.38
RAB9A P51151 1/20 0.38
DRD2 P14416 5/20 0.37
CCR3 P51677 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
KMT2A Q03164 2/20 0.36
HTT P42858 1/20 0.36
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
MEN1 O00255 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
SCHEMBL4026436 0.87 KDM2B (0.42) KDM2BRAB9ADRD2L3MBTL1ALDH1A1
SCHEMBL4020026 0.86 KDM2B (0.42) KDM2BRAB9ADRD2L3MBTL1KDM4E
SCHEMBL4021139 0.84 KDM2B (0.43) KDM2BRAB9ADRD2L3MBTL1KDM4E
SCHEMBL4749342 0.84 KDM2B (0.40) KDM2BDRD4DRD2ALDH1A1KMT2A
SCHEMBL4022127 0.81 KDM2B (0.39) KDM2BDRD4RAB9ADRD2CCR3
SCHEMBL4023627 0.81 KDM2B (0.39) KDM2BDRD4RAB9ADRD2CCR3
SCHEMBL13721312 0.81 KDM2B (0.39) KDM2BDRD4RAB9ADRD2CCR3
SCHEMBL4023629 0.81 KDM2B (0.39) KDM2BDRD4RAB9ADRD2CCR3
SCHEMBL4019347 0.81 MEN1 (0.33) KMT2AMEN1
SCHEMBL4019477 0.80 DRD4 (0.41) KDM2BDRD4DRD2CCR3CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7572814-B2 3,5-dibenzoyl-4-phenyl-piperidine anti-cancer compounds CYTOKINETICS, INCORPORATED (US) 2009-08-11 US claimed
EP-1962846-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2008-09-03 EP claimed
WO-2007059323-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2007-05-24 WO claimed
US-7572814-B2 3,5-dibenzoyl-4-phenyl-piperidine anti-cancer compounds CYTOKINETICS, INCORPORATED (US) 2009-08-11 US disclosed
US-20070161674-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. 2007-07-12 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-20070161674-A1 Certain chemical entities, compositions, and methods TP53, VHL, RB1 KDM2B 3090/4885DRD4 2983/4885RAB9A 2228/4885

“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.