SCHEMBL4023240

SCHEMBL4023240

COCCN1CCC(N2C[C@H](C(=O)c3cccc(O)c3)[C@@H](c3cccc(F)c3C)[C@@H](C(=O)N3CCC[C@H]3C(F)(F)F)C2)CC1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM2B Q8NHM5 3/20 0.32
PARP1 P09874 1/20 0.32
KDR P35968 2/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPK1 P28482 1/20 0.31
KCNH2 Q12809 2/20 0.31
DRD2 P14416 1/20 0.31
DRD3 P35462 1/20 0.31
TACR1 P25103 1/20 0.31
LYN P07948 1/20 0.31
GRK2 P25098 1/20 0.31
CLK1 P49759 1/20 0.31
GSK3A P49840 1/20 0.31
GSK3B P49841 1/20 0.31
MAPK7 Q13164 1/20 0.31
DYRK1A Q13627 1/20 0.31
DYRK2 Q92630 1/20 0.31
NPC1 O15118 1/20 0.31
TNF P01375 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL4025711 0.92 DRD2 (0.32) KCNH2DRD2DRD3TACR1RAB9A
SCHEMBL4788062 0.88 MEN1 (0.33) KDM2BALDH1A1MAPK1TACR1MEN1
SCHEMBL4749520 0.84 SCN9A (0.32) KDM2BRAB9ASCN9A
SCHEMBL13721158 0.84 BCHE (0.35) KDM2BALDH1A1TACR1MEN1KMT2A
SCHEMBL4022836 0.84 BCHE (0.35) KDM2BALDH1A1TACR1MEN1KMT2A
SCHEMBL4028516 0.84 BCHE (0.35) KDM2BALDH1A1TACR1MEN1KMT2A
SCHEMBL4028513 0.84 BCHE (0.35) KDM2BALDH1A1TACR1MEN1KMT2A
SCHEMBL4022533 0.84 BCHE (0.35) KDM2BALDH1A1TACR1MEN1KMT2A
SCHEMBL4020878 0.84 SCN9A (0.32) KDM2BSCN9A
SCHEMBL4028507 0.84 BCHE (0.35) KDM2BALDH1A1TACR1MEN1KMT2A

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 2 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 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 3090/4885PARP1 901/4885KDR 4166/4885

“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.