SCHEMBL15344221

SCHEMBL15344221

CN[C@@H](C)C(=O)NCCCNc1ncc(C=O)s1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 1/20 0.34
CSNK2B P67870 1/20 0.34
CSNK2A1 P68400 1/20 0.34
CSNK2A3 Q8NEV1 1/20 0.34
P2RY2 P41231 4/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CCNE1 P24864 1/20 0.32
CDK2 P24941 1/20 0.32
CDK5 Q00535 1/20 0.32
MAPK14 Q16539 2/20 0.31
LCK P06239 1/20 0.31
APP P05067 1/20 0.31
BCHE P06276 1/20 0.31
ACHE P22303 1/20 0.31
NAMPT P43490 1/20 0.30
POLB P06746 1/20 0.30
FPR3 P25089 1/20 0.30
FPR2 P25090 1/20 0.30

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
SCHEMBL15328312 0.88 P2RY2 (0.34) CSNK2A2CSNK2BCSNK2A1CSNK2A3P2RY2
SCHEMBL15328213 0.88 CSNK2A2 (0.37) CSNK2A2CSNK2BCSNK2A1CSNK2A3P2RY2
SCHEMBL15328215 0.88 CSNK2A2 (0.37) CSNK2A2CSNK2BCSNK2A1CSNK2A3P2RY2
SCHEMBL15328610 0.87 CSNK2A2 (0.34) CSNK2A2CSNK2BCSNK2A1CSNK2A3P2RY2
SCHEMBL15328614 0.87 CSNK2A2 (0.34) CSNK2A2CSNK2BCSNK2A1CSNK2A3P2RY2
SCHEMBL17074557 0.86 P2RY2 (0.33) CSNK2A2CSNK2BCSNK2A1CSNK2A3P2RY2
SCHEMBL15328386 0.86 CSNK2A2 (0.34) CSNK2A2CSNK2BCSNK2A1CSNK2A3P2RY2
SCHEMBL17074554 0.86 P2RY2 (0.33) CSNK2A2CSNK2BCSNK2A1CSNK2A3P2RY2
SCHEMBL15328383 0.86 CSNK2A2 (0.34) CSNK2A2CSNK2BCSNK2A1CSNK2A3P2RY2
SCHEMBL15344127 0.83 P2RY2 (0.43) P2RY2KMT2AFPR3FPR2

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-9169295-B2 Macrocycles and macrocycle stabilized peptides BRISTOL-MYERS SQUIBB COMPANY (US) 2015-10-27 US disclosed
US-20130281657-A1 MACROCYCLES AND MACROCYCLE STABILIZED PEPTIDES BRISTOL-MYERS SQUIBB COMPANY (US) 2013-10-24 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-20130281657-A1 MACROCYCLES AND MACROCYCLE STABILIZED PEPTIDES PTMS, VIP, MTPN CSNK2A2 2005/4885CSNK2B 1944/4885CSNK2A1 1778/4885

“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.