SCHEMBL4021978

SCHEMBL4021978

CNC(=O)CN1CC(C(=O)c2cccc(F)c2)C(c2cccc(C)c2C)C(C(=O)c2cccc(F)c2)C1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
ALDH1A1 P00352 7/20 0.38
GAA P10253 1/20 0.38
GRIN2B Q13224 2/20 0.37
REV1 Q9UBZ9 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
DRD4 P21917 2/20 0.35
TSHR P16473 2/20 0.35
LMNA P02545 2/20 0.35
USP2 O75604 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
SCHEMBL4021974 1.00 MEN1 (0.42) MEN1KMT2AALDH1A1GAAGRIN2B
SCHEMBL4028145 0.89 MEN1 (0.38) MEN1KMT2AALDH1A1GAAGRIN2B
SCHEMBL4028188 0.89 MEN1 (0.38) MEN1KMT2AALDH1A1GAAGRIN2B
SCHEMBL4028149 0.89 MEN1 (0.38) MEN1KMT2AALDH1A1GAAGRIN2B
SCHEMBL4022953 0.87 ALDH1A1 (0.39) MEN1KMT2AALDH1A1GAAGRIN2B
SCHEMBL4022948 0.87 ALDH1A1 (0.39) MEN1KMT2AALDH1A1GAAGRIN2B
SCHEMBL4026452 0.85 ALDH1A1 (0.40) MEN1KMT2AALDH1A1GAAGRIN2B
SCHEMBL4028159 0.84 ALDH1A1 (0.39) MEN1KMT2AALDH1A1GAAGRIN2B
SCHEMBL4019455 0.83 DRD4 (0.37) MEN1KMT2AALDH1A1GRIN2BDRD4
SCHEMBL4019453 0.83 DRD4 (0.37) MEN1KMT2AALDH1A1GRIN2BDRD4

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-7572814-B2 3,5-dibenzoyl-4-phenyl-piperidine anti-cancer compounds CYTOKINETICS, INCORPORATED (US) 2009-08-11 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 MEN1 77/4885KMT2A 2820/4885ALDH1A1 258/4885

“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.