SCHEMBL5200976

SCHEMBL5200976

COC(=O)C1C[C@@H](O)CN1C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 4/20 0.41
SCN9A Q15858 1/20 0.40
ANPEP P15144 2/20 0.40
ALDH1A1 P00352 3/20 0.39
KMT2A Q03164 4/20 0.39
CYP3A4 P08684 3/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 2/20 0.39
POLB P06746 1/20 0.39
KCNN4 O15554 1/20 0.38
SLC6A4 P31645 2/20 0.38
BRD4 O60885 2/20 0.37
SLC6A3 Q01959 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL3548775 1.00 MMP2 (0.41) MMP2SCN9AANPEPALDH1A1KMT2A
SCHEMBL29276034 1.00 MMP2 (0.41) MMP2SCN9AANPEPALDH1A1KMT2A
SCHEMBL31696759 1.00 MMP2 (0.41) MMP2SCN9AANPEPALDH1A1KMT2A
SCHEMBL26062663 1.00 MMP2 (0.41) MMP2SCN9AANPEPALDH1A1KMT2A
SCHEMBL3548773 1.00 MMP2 (0.41) MMP2SCN9AANPEPALDH1A1KMT2A
SCHEMBL2298094 0.87 KCNN4 (0.43) MMP2ANPEPALDH1A1KMT2ACYP3A4
SCHEMBL992573 0.87 KCNN4 (0.43) MMP2ANPEPALDH1A1KMT2ACYP3A4
SCHEMBL992574 0.87 KCNN4 (0.43) MMP2ANPEPALDH1A1KMT2ACYP3A4
SCHEMBL14762802 0.85 ALDH1A1 (0.44) ALDH1A1KMT2AKDM4EMEN1CYP1A2
SCHEMBL6586331 0.85 MMP2 (0.41) MMP2ANPEPKMT2ACYP3A4KCNN4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1539744-A4 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARM INC (US) 2007-06-06 EP disclosed
EP-1539744-A2 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY Vicuron Pharmaceuticals, Inc. (US) 2005-06-15 EP disclosed
EP-1465864-A1 INHIBITORS OF FACTOR XA AND OTHER SERINE PROTEASES INVOLVED IN THE COAGULATION CASCADE Warner-Lambert Company LLC (US) 2004-10-13 EP disclosed
WO-2004007444-A2 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS, INC. (US) 2004-01-22 WO disclosed
WO-2003045912-A1 INHIBITORS OF FACTOR XA AND OTHER SERINE PROTEASES INVOLVED IN THE COAGULATION CASCADE WARNER-LAMBERT COMPANY LLC (US) 2003-06-05 WO disclosed