SCHEMBL3787271

SCHEMBL3787271

CCCCC1CN[C@H](C(=O)O)C1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 2/20 0.60
ALDH1A1 P00352 3/20 0.46
USP2 O75604 1/20 0.46
GAA P10253 1/20 0.46
CYP1A2 P05177 2/20 0.46
ALOX15 P16050 2/20 0.46
CYP2C19 P33261 2/20 0.46
CYP2D6 P10635 1/20 0.46
SLC1A3 P43003 1/20 0.46
SLC1A2 P43004 1/20 0.46
SLC1A1 P43005 1/20 0.46
GLB1 P16278 1/20 0.41
DPP4 P27487 1/20 0.41
S1PR3 Q99500 2/20 0.41
MEN1 O00255 1/20 0.39
THRB P10828 1/20 0.39
KMT2A Q03164 1/20 0.39
GRIN2D O15399 1/20 0.39
GRIN3B O60391 1/20 0.39
GRIA1 P42261 1/20 0.39

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
SCHEMBL5511790 1.00 ARG1 (0.60) ARG1ALDH1A1USP2GAACYP1A2
SCHEMBL3780786 0.95 ARG1 (0.58) ARG1ALDH1A1USP2GAACYP1A2
SCHEMBL4867875 0.95 ARG1 (0.58) ARG1ALDH1A1USP2GAACYP1A2
SCHEMBL1034091 0.89 ARG1 (0.64) ARG1ALDH1A1USP2GAACYP1A2
SCHEMBL11650754 0.89 ARG1 (0.64) ARG1ALDH1A1USP2GAACYP1A2
SCHEMBL3776510 0.89 ARG1 (0.64) ARG1ALDH1A1USP2GAACYP1A2
SCHEMBL26118062 0.89 ARG1 (0.64) ARG1ALDH1A1USP2GAACYP1A2
SCHEMBL17592409 0.84 ALDH1A1 (0.45) ARG1ALDH1A1USP2GAACYP1A2
SCHEMBL17592441 0.84 ALDH1A1 (0.45) ARG1ALDH1A1USP2GAACYP1A2
SCHEMBL17592443 0.84 ALDH1A1 (0.45) ARG1ALDH1A1USP2GAACYP1A2

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
WO-2010127645-A2 THE METHOD OF BIOTECHNOLOGICAL PREPARATION OF LINCOMYCIN DERIVATIVES AND ITS USING INSTITUTE OF MICROBIOLOGY AS CR, V. V. I. (CZ) 2010-11-11 WO disclosed