SCHEMBL4027951

SCHEMBL4027951

COc1cccc(C(=O)[C@H]2CN(CC(=O)N(C)C)C[C@H](C(=O)c3cccc(OC)c3)C2c2cccc(F)c2C)c1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM2B Q8NHM5 9/20 0.43
KMT2A Q03164 4/20 0.40
HTT P42858 1/20 0.40
GRIN2B Q13224 2/20 0.40
MEN1 O00255 3/20 0.39
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ABL1 P00519 1/20 0.39
EGFR P00533 1/20 0.39
SRC P12931 1/20 0.39
ABL2 P42684 1/20 0.39
ALDH1A1 P00352 2/20 0.38
HSD11B1 P28845 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL4027956 1.00 KDM2B (0.43) KDM2BKMT2AHTTGRIN2BMEN1
SCHEMBL4026851 0.91 KMT2A (0.44) KDM2BKMT2AGRIN2BMEN1L3MBTL1
SCHEMBL4026855 0.91 KMT2A (0.44) KDM2BKMT2AGRIN2BMEN1L3MBTL1
SCHEMBL4024035 0.89 ALDH1A1 (0.37) KMT2AMEN1L3MBTL1ALDH1A1LMNA
SCHEMBL4024037 0.89 ALDH1A1 (0.37) KMT2AMEN1L3MBTL1ALDH1A1LMNA
SCHEMBL4780092 0.88 KDM2B (0.43) KDM2BKMT2AHTTMEN1NPSR1
SCHEMBL4022383 0.88 KDM2B (0.43) KDM2BKMT2AHTTGRIN2BMEN1
SCHEMBL4022380 0.88 KDM2B (0.43) KDM2BKMT2AHTTGRIN2BMEN1
SCHEMBL4024477 0.87 ABL1 (0.37) KDM2BKMT2AGRIN2BMEN1ABL1
SCHEMBL4024473 0.87 ABL1 (0.37) KDM2BKMT2AGRIN2BMEN1ABL1

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 4 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
US-20070161674-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. 2007-07-12 US 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 3090/4885KMT2A 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.