SCHEMBL7730257

SCHEMBL7730257

CCOC(=O)CCNC(=O)C(=O)NCC(C)=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.43
▸ MGAM O43451 1/20 0.43
▸ SI P14410 1/20 0.43
▸ MGAM2 Q2M2H8 1/20 0.43
▸ EGLN1 Q9GZT9 1/20 0.42
▸ CYP1A2 P05177 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ ALDH1A1 P00352 4/20 0.36
▸ TRPA1 O75762 1/20 0.36
▸ TOP2A P11388 1/20 0.36
▸ HSD17B10 Q99714 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MLYCD O95822 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ EPHX2 P34913 1/20 0.35

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
SCHEMBL15201482 0.87 GAA (0.52) GAAMGAMSIMGAM2EGLN1
SCHEMBL5885508 0.85 GAA (0.53) GAAMGAMSIMGAM2EGLN1
SCHEMBL10081654 0.80 GAA (0.50) GAAMGAMSIMGAM2CYP1A2
SCHEMBL8578892 0.80 CYP1A2 (0.46) GAAMGAMSIMGAM2CYP1A2
SCHEMBL27805389 0.79 GAA (0.48) GAAMGAMSIMGAM2EGLN1
SCHEMBL7737241 0.79 EGLN1 (0.55) GAAMGAMSIMGAM2EGLN1
SCHEMBL15201379 0.79 GAA (0.55) GAAMGAMSIMGAM2EGLN1
SCHEMBL48439 0.79 GAA (0.52) GAAMGAMSIMGAM2CYP1A2
SCHEMBL14902246 0.78 GAA (0.46) GAAMGAMSIMGAM2CYP1A2
SCHEMBL13991912 0.78 GAA (0.46) GAAMGAMSIMGAM2EGLN1

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-6777431-B2 ANTICOAGULANTS CORVAS INTERNATIONAL, INC. 2004-08-17 — — US disclosed
US-6777431-B2 ANTICOAGULANTS CORVAS INTERNATIONAL, INC. 2004-08-17 — — US disclosed
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