SCHEMBL4028191

SCHEMBL4028191

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

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
KDM2B Q8NHM5 2/20 0.34
HTR1A P08908 6/20 0.34
DRD1 P21728 6/20 0.34
DRD4 P21917 6/20 0.34
DRD5 P21918 6/20 0.34
DRD3 P35462 6/20 0.34
DRD2 P14416 5/20 0.33
ESR1 P03372 2/20 0.33
MGLL Q99685 1/20 0.33
OPRM1 P35372 2/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32

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
SCHEMBL4029040 0.99 DRD3 (0.35) KIF11MEN1KMT2AKDM2BHTR1A
SCHEMBL4748997 0.98 MEN1 (0.34) KIF11MEN1KMT2AKDM2BHTR1A
SCHEMBL4749199 0.98 MEN1 (0.34) KIF11MEN1KMT2AKDM2BHTR1A
SCHEMBL4752024 0.97 KIF11 (0.34) KIF11MEN1KMT2AKDM2BHTR1A
SCHEMBL4752015 0.97 KIF11 (0.34) KIF11MEN1KMT2AKDM2BHTR1A
SCHEMBL4751597 0.96 DRD3 (0.33) KIF11MEN1KMT2AKDM2BHTR1A
SCHEMBL4751355 0.95 KDM2B (0.33) KIF11MEN1KMT2AKDM2BHTR1A
SCHEMBL4751349 0.95 KDM2B (0.33) KIF11MEN1KMT2AKDM2BHTR1A
SCHEMBL4024540 0.94 MEN1 (0.35) KIF11MEN1KMT2AKDM2BMGLL
SCHEMBL13720775 0.94 MEN1 (0.35) KIF11MEN1KMT2AKDM2BMGLL

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 KIF11 3745/4885MEN1 77/4885KMT2A 2820/4885

“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.