SCHEMBL890405

SCHEMBL890405

N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H]([C]=O)Cc1ccc(O)cc1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSC P53634 4/20 0.57
SLC7A5 Q01650 1/20 0.54
YARS1 P54577 2/20 0.52
MMP2 P08253 1/20 0.48
ERAP2 Q6P179 1/20 0.46
LNPEP Q9UIQ6 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CTSH P09668 1/20 0.46
CYP2D6 P10635 1/20 0.46
CTSK P43235 1/20 0.46
OPRD1 P41143 5/20 0.46
OPRM1 P35372 4/20 0.46
OPRK1 P41145 1/20 0.46

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
SCHEMBL890404 1.00 CTSC (0.57) CTSCSLC7A5YARS1MMP2ERAP2
SCHEMBL8893265 0.94 CTSC (0.67) CTSCSLC7A5YARS1CYP1A2CYP3A4
SCHEMBL9293695 0.94 CTSC (0.67) CTSCSLC7A5YARS1CYP1A2CYP3A4
SCHEMBL9143188 0.94 CTSC (0.67) CTSCSLC7A5YARS1CYP1A2CYP3A4
SCHEMBL5996736 0.94 CTSC (0.67) CTSCSLC7A5YARS1CYP1A2CYP3A4
SCHEMBL516225 0.91 CTSC (0.48) CTSCSLC7A5YARS1MMP2CYP1A2
SCHEMBL27468879 0.91 CTSC (0.48) CTSCSLC7A5YARS1MMP2CYP1A2
SCHEMBL27650437 0.91 SLC7A5 (0.51) CTSCSLC7A5YARS1MMP2ERAP2
SCHEMBL11597695 0.89 CTSC (0.49) CTSCSLC7A5YARS1MMP2ERAP2
SCHEMBL2191632 0.88 OPRD1 (0.61) CTSCCYP1A2CYP3A4CTSHCYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106456701-A Modulation of complement activity RA制药公司 2017-02-22 CN disclosed
US-20120083008-A1 Methods for obtaining molecules with reduced immunogenicity MARSHALL CHRISTOPHER P (US) 2012-04-05 US disclosed
EP-1282722-B1 STABILIZED PROTEINS AVATAR MEDICAL L L C (US) 2011-06-15 EP disclosed
US-7445912-B2 Stabilized proteins AVATAR MEDICAL LLC (US) 2008-11-04 US disclosed
US-20070184518-A1 Stabilized proteins AVATAR MEDICAL LLC (US) 2007-08-09 US disclosed
US-7037894-B2 Stabilized proteins AVATAR MEDICAL, LLC (US) 2006-05-02 US disclosed
US-20050123530-A1 Stabilized proteins AVATAR MEDICAL, LLC (US) 2005-06-09 US disclosed
US-20050054572-A1 Methods for obtaining molecules with reduced immunogenicity CALDER BIOSCIENCES INC. 2005-03-10 US disclosed
EP-1282722-A4 STABILIZED PROTEINS AVATAR MEDICAL L L C (US) 2004-04-07 EP disclosed
EP-1282722-A1 STABILIZED PROTEINS Avatar Medical, L.L.C. (US) 2003-02-12 EP disclosed
US-20020061549-A1 Stabilized proteins CALDER BIOSCIENCES INC. 2002-05-23 US disclosed
WO-2001029247-A1 STABILIZED PROTEINS AVATAR MEDICAL, LLC (US) 2001-04-26 WO disclosed