SCHEMBL4020633

SCHEMBL4020633

Cc1c(F)cccc1C1[C@@H](C(=O)c2cccc(O)c2)CN(CCO)C[C@@H]1C(=O)c1cccc(O)c1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
KDM2B Q8NHM5 4/20 0.35
MGLL Q99685 3/20 0.34
ESRRG P62508 2/20 0.33
MC4R P32245 1/20 0.33
MAPK1 P28482 1/20 0.33
SLC2A1 P11166 1/20 0.33
SLC2A4 P14672 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 1/20 0.33

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
SCHEMBL4751303 0.96 KDM2B (0.33) MEN1KMT2AKDM2BMGLLESRRG
SCHEMBL4028155 0.94 KMT2A (0.34) MEN1KMT2AKDM2BMGLLESRRG
SCHEMBL4019668 0.93 HRH2 (0.34) MEN1KMT2AKDM2BMGLLESRRG
SCHEMBL4025770 0.93 KDM2B (0.41) MEN1KMT2AKDM2BMGLL
SCHEMBL4029269 0.92 KDM2B (0.35) MEN1KMT2AKDM2BMGLL
SCHEMBL4020144 0.92 DPP4 (0.38) KDM2BMGLLMC4R
SCHEMBL4024566 0.92 EED (0.33) MEN1KMT2AKDM2B
SCHEMBL4022073 0.92 MEN1 (0.36) MEN1KMT2AKDM2BMGLLMC4R
SCHEMBL13720775 0.92 MEN1 (0.35) MEN1KMT2AKDM2BMGLLMAPK1
SCHEMBL4024540 0.92 MEN1 (0.35) MEN1KMT2AKDM2BMGLLMAPK1

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 MEN1 77/4885KMT2A 2820/4885KDM2B 3090/4885

“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.