SCHEMBL7820091

SCHEMBL7820091

CCOC(=O)NCC1(O)CCNCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.41
SMYD3 Q9H7B4 2/20 0.40
KMT2A Q03164 3/20 0.36
KDM4E B2RXH2 2/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
ALOX15 P16050 1/20 0.36
LMNA P02545 1/20 0.34
P2RX7 Q99572 2/20 0.33
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
HCN1 O60741 1/20 0.33
HCN3 Q9P1Z3 1/20 0.33
HCN2 Q9UL51 1/20 0.33
HCN4 Q9Y3Q4 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33

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
SCHEMBL17606553 0.80 EPHX1 (0.40) OPRM1SMYD3GAACYP2C19
SCHEMBL2348782 0.80 HCRTR2 (0.40) SMYD3KMT2AKDM4EMEN1LMNA
SCHEMBL1313231 0.80 SMYD3 (0.44) OPRM1SMYD3KMT2AKDM4EP2RX7
SCHEMBL28543808 0.78 SMYD3 (0.43) OPRM1SMYD3KMT2AKDM4EALOX15
SCHEMBL21551513 0.78 SMYD3 (0.43) OPRM1SMYD3KMT2AKDM4EALOX15
Hydrochloric Acid SCHEMBL19995691 0.78 SMYD3 (0.43) OPRM1SMYD3KMT2AKDM4EP2RX7
SCHEMBL16365228 0.76 TSHR (0.35) SMYD3KMT2AKDM4ETSHR
SCHEMBL21551515 0.76 SMYD3 (0.44) SMYD3KMT2AKDM4EMEN1LMNA
SCHEMBL21551460 0.75 SMYD3 (0.45) OPRM1SMYD3KMT2AKDM4EP2RX7
SCHEMBL4113341 0.75 OPRM1 (0.43) OPRM1KMT2AKDM4EMEN1MAPT

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-6323217-B2 CARDIOVASCULAR DISORDERS ADIR ET COMPAGNIE (FR) 2001-11-27 US disclosed
US-20010034352-A1 Piperidine-4 sulphonamide compounds LES LABORATOIRES SERVIER (FR) 2001-10-25 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-20010034352-A1 Piperidine-4 sulphonamide compounds KDR, GLS, FLT1 OPRM1 168/4885SMYD3 1509/4885KMT2A 2683/4885

“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.