SCHEMBL4018780

SCHEMBL4018780

COc1cccc(C(=O)C2CN(C[C@@H](C)O)CC(C(=O)c3cccc(OC)c3)C2c2cccc(F)c2C)c1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM2B Q8NHM5 11/20 0.43
KMT2A Q03164 3/20 0.40
HTT P42858 1/20 0.40
MEN1 O00255 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 3/20 0.38
HSD11B1 P28845 1/20 0.38
LMNA P02545 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
FPR1 P21462 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL13721307 1.00 KDM2B (0.43) KDM2BKMT2AHTTMEN1NPSR1
SCHEMBL4018783 1.00 KDM2B (0.43) KDM2BKMT2AHTTMEN1NPSR1
SCHEMBL4023530 0.92 KDM2B (0.43) KDM2BKMT2AHTTMEN1NPSR1
SCHEMBL4023604 0.91 KDM2B (0.42) KDM2BKMT2AHTTMEN1NPSR1
SCHEMBL4028175 0.90 KDM2B (0.41) KDM2BKMT2AHTTMEN1NPSR1
SCHEMBL4027144 0.90 KDM2B (0.41) KDM2BKMT2AHTTMEN1NPSR1
SCHEMBL4023878 0.87 KDM2B (0.34) KDM2BKMT2AMEN1ALDH1A1
SCHEMBL4022530 0.87 KDM2B (0.34) KDM2BKMT2AMEN1ALDH1A1
SCHEMBL13721304 0.87 KDM2B (0.34) KDM2BKMT2AMEN1ALDH1A1
SCHEMBL4022184 0.87 KMT2A (0.36) KDM2BKMT2AHTTMEN1NPSR1

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 2 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 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 3090/4885KMT2A 2820/4885HTT 2084/4885

“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.