SCHEMBL3744397

SCHEMBL3744397

CC(=O)[C@@](N)(CCCN)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ODC1 P11926 2/20 0.48
LMNA P02545 3/20 0.46
BLM P54132 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MAPT P10636 1/20 0.46
RAB9A P51151 1/20 0.46
PMP22 Q01453 1/20 0.46
PAOX Q6QHF9 3/20 0.37
THRB P10828 3/20 0.36
KMT2A Q03164 3/20 0.36
NPSR1 Q6W5P4 2/20 0.36
CYP1A2 P05177 2/20 0.36
GABRR3 A8MPY1 1/20 0.36
GABRP O00591 1/20 0.36
GABRD O14764 1/20 0.36
HDAC3 O15379 1/20 0.36
GABBR2 O75899 1/20 0.36
GABRA1 P14867 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL3744393 1.00 ODC1 (0.48) ODC1LMNABLMSMN1; SMN2KDM4E
SCHEMBL3627363 1.00 ODC1 (0.48) ODC1LMNABLMSMN1; SMN2KDM4E
SCHEMBL522662 0.94 ODC1 (0.42) ODC1LMNABLMSMN1; SMN2KDM4E
SCHEMBL522663 0.94 ODC1 (0.42) ODC1LMNABLMSMN1; SMN2KDM4E
Hydrochloric Acid SCHEMBL8205380 0.92 BLM (0.43) ODC1LMNABLMSMN1; SMN2KDM4E
Hydrochloric Acid SCHEMBL8205379 0.92 BLM (0.43) ODC1LMNABLMSMN1; SMN2KDM4E
SCHEMBL28792659 0.86 ODC1 (0.38) ODC1LMNABLMSMN1; SMN2KDM4E
SCHEMBL20636765 0.86 ODC1 (0.38) ODC1LMNABLMSMN1; SMN2KDM4E
SCHEMBL29116696 0.86 ODC1 (0.56) ODC1LMNABLMSMN1; SMN2KDM4E
SCHEMBL872443 0.83 FDPS (0.42) THRBKMT2ACYP1A2TSHRHDAC11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118112227-A Fecal markers, diagnostic products and methods for diagnosing eimeria ovine infection 河南农业大学 2024-05-31 CN disclosed
US-20130309697-A1 BIOMARKERS FOR PROSTATE CANCER AND METHODS USING THE SAME MITCHELL MATTHEW W (US) 2013-11-21 US disclosed
US-8518650-B2 Biomarkers for prostate cancer and methods using the same METABOLON, INC. (US) 2013-08-27 US disclosed
US-20100292331-A1 Biomarkers for Prostate Cancer and Methods Using the Same METABALON, INC. (US) 2010-11-18 US disclosed