SCHEMBL4020303

SCHEMBL4020303

CCCN1C[C@H](C(=O)c2ccccc2Br)C(c2cccc(F)c2C)[C@@H](C(=O)c2ccccc2Br)C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MC4R P32245 2/20 0.37
SLC6A1 P30531 1/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
EED O75530 1/20 0.35
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.35
HTT P42858 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KDM2B Q8NHM5 2/20 0.34
TAS1R3 Q7RTX0 1/20 0.34
TAS1R1 Q7RTX1 1/20 0.34
TAS1R2 Q8TE23 1/20 0.34
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34
PARP1 P09874 1/20 0.34

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
SCHEMBL4024177 0.86 EED (0.36) SLC6A1MEN1KMT2AEEDALDH1A1
SCHEMBL4022107 0.86 EED (0.36) SLC6A1MEN1KMT2AEEDALDH1A1
SCHEMBL4022304 0.83 TAS1R3 (0.39) MC4RSLC6A1MEN1KMT2AALDH1A1
SCHEMBL4794086 0.81 EED (0.31) EED
SCHEMBL4021607 0.81 EED (0.33) MC4RSLC6A1MEN1KMT2AEED
SCHEMBL4027984 0.80 TAS1R3 (0.37) MC4RMEN1KMT2AEEDALDH1A1
SCHEMBL4019773 0.80 EED (0.33) SLC6A1MEN1KMT2AEEDALDH1A1
SCHEMBL4019770 0.80 EED (0.33) SLC6A1MEN1KMT2AEEDALDH1A1
SCHEMBL4023645 0.79 KDM2B (0.39) MC4RSLC6A1MEN1KMT2AALDH1A1
SCHEMBL4025103 0.78 KDM2B (0.41) SLC6A1MEN1KMT2AALDH1A1SMN1; SMN2

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
US-7572814-B2 3,5-dibenzoyl-4-phenyl-piperidine anti-cancer compounds CYTOKINETICS, INCORPORATED (US) 2009-08-11 US disclosed
EP-1962846-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2008-09-03 EP disclosed
US-20070161674-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. 2007-07-12 US disclosed
WO-2007059323-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2007-05-24 WO 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 MC4R 3874/4885SLC6A1 4570/4885MEN1 77/4885

“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.