SCHEMBL5983633

SCHEMBL5983633

N[C@@H](CC1CCCC1)C(=O)NC1CCCNCC1O

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 3/20 0.39
CPN1 P15169 2/20 0.39
KMT2A Q03164 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
ATM Q13315 1/20 0.34
CYP2D6 P10635 1/20 0.34
CIT O14578 2/20 0.34
EPHX1 P07099 1/20 0.33
SLC6A1 P30531 2/20 0.32
SLC6A11 P48066 1/20 0.32
TSHR P16473 1/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
SLC6A13 Q9NSD5 1/20 0.32
METAP2 P50579 2/20 0.32
METAP1 P53582 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
SCHEMBL5099315 0.81 ARG1 (0.43) CPB2CPN1KMT2AKDM4EMAPT
SCHEMBL4769110 0.80 CPB2 (0.42) CPB2CPN1
SCHEMBL4769116 0.80 CPB2 (0.42) CPB2CPN1
SCHEMBL6206698 0.74 KDM4E (0.38) CPB2CPN1KMT2AKDM4EMAPT
SCHEMBL5096660 0.74 CTSS (0.56) CPB2
SCHEMBL27206103 0.73 KMT2A (0.44) CPB2KMT2AEPHX1LMNASMN1; SMN2
SCHEMBL27192634 0.73 KMT2A (0.44) CPB2KMT2AEPHX1LMNASMN1; SMN2
SCHEMBL6217307 0.73 METAP2 (0.42) KMT2AMETAP2METAP1
Hydrochloric Acid SCHEMBL27206119 0.71 KMT2A (0.43) CPB2KMT2AEPHX1LMNASMN1; SMN2
Hydrochloric Acid SCHEMBL27192716 0.71 KMT2A (0.43) CPB2KMT2AEPHX1LMNASMN1; SMN2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060052365-A1 Protease inhibitors SMITHKLINE BEECHAM CORPORATION 2006-03-09 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-20060052365-A1 Protease inhibitors CTSS, CTSE, CMA1 CPB2 57/4885CPN1 25/4885KMT2A 3606/4885

“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.