SCHEMBL7435814

SCHEMBL7435814

CCOC(=O)CO[C@@]1(C(=O)O)CCCN1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.34
GAA P10253 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
KMT2A Q03164 2/20 0.34
KDM4E B2RXH2 4/20 0.33
TSHR P16473 1/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33
OPRM1 P35372 1/20 0.33
TRPA1 O75762 1/20 0.32
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
ARG1 P05089 1/20 0.31
ARG2 P78540 1/20 0.31
NLRP3 Q96P20 1/20 0.31
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL7340984 0.83 ARG1 (0.36) KMT2AKDM4EMEN1MAPTALOX15
SCHEMBL2339284 0.77 TSHR (0.36) KMT2ATSHRMEN1ARG1ARG2
SCHEMBL18985191 0.72 CYP2D6 (0.33) ARG1ARG2
SCHEMBL7341869 0.71
SCHEMBL7338385 0.70 ARG1 (0.35) ARG1ARG2
SCHEMBL7338721 0.70 ARG1 (0.35) ARG1ARG2
SCHEMBL6547926 0.70 MEN1 (0.37) KMT2ATSHRMEN1ALDH1A1ARG1
SCHEMBL7340979 0.69 ARG1 (0.33) ARG1ARG2
SCHEMBL7349345 0.69 SLC1A3 (0.35) TSHRARG1ARG2
SCHEMBL8249142 0.69 OPRM1 (0.41) GAAKMT2AKDM4EMEN1MAPT

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
EP-0384636-A1 Pharmaceutically active compounds FISONS plc (GB) 1990-08-29 EP disclosed