SCHEMBL4021860

SCHEMBL4021860

Cc1ccc(F)c(C2[C@@H](C(=O)c3cccc(O)c3)CN(CCO)C[C@@H]2C(=O)c2cccc(O)c2)c1F

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
MAPK1 P28482 1/20 0.34
MGLL Q99685 3/20 0.33
KDM2B Q8NHM5 3/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32
MC4R P32245 1/20 0.32
F10 P00742 1/20 0.32
KIF11 P52732 1/20 0.32
KCNH2 Q12809 1/20 0.32
ESRRG P62508 1/20 0.32
OPRM1 P35372 1/20 0.32
OPRD1 P41143 1/20 0.32
MRGPRX4 Q96LA9 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
SCHEMBL4022438 0.87 KDM1A (0.33) MEN1KMT2AMAPK1MGLLKDM2B
SCHEMBL4027068 0.86 GRIN1 (0.35) MGLLKDM2BGRIN1GRIN2BKIF11
SCHEMBL4021304 0.83 HRH3 (0.30)
SCHEMBL4020633 0.82 MEN1 (0.35) MEN1KMT2AMAPK1MGLLKDM2B
SCHEMBL4024566 0.81 EED (0.33) MEN1KMT2AKDM2BGRIN1GRIN2B
SCHEMBL4751303 0.78 KDM2B (0.33) MEN1KMT2AMAPK1MGLLKDM2B
SCHEMBL4019668 0.78 HRH2 (0.34) MEN1KMT2AMGLLKDM2BMC4R
SCHEMBL4022053 0.78 MGLL (0.36) MEN1KMT2AMAPK1MGLLKDM2B
SCHEMBL4028155 0.77 KMT2A (0.34) MEN1KMT2AMGLLKDM2BESRRG
SCHEMBL4029269 0.77 KDM2B (0.35) MEN1KMT2AMGLLKDM2B

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 2820/4885MAPK1 4193/4885

“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.