SCHEMBL1969475

SCHEMBL1969475

CC[C@](NS(=O)(=O)c1ccccc1[N+](=O)[O-])(C(=O)O)c1ccc(OC)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.45
PKM P14618 1/20 0.45
THRB P10828 1/20 0.45
SLC10A6 Q3KNW5 1/20 0.44
MMP1 P03956 4/20 0.44
MMP9 P14780 4/20 0.44
MMP13 P45452 4/20 0.44
MMP2 P08253 3/20 0.44
MMP8 P22894 3/20 0.44
CA2 P00918 2/20 0.44
CA1 P00915 1/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
KMT2A Q03164 4/20 0.44
MEN1 O00255 2/20 0.44
USP2 O75604 1/20 0.44
AR P10275 1/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
GAA P10253 2/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL1969478 1.00 LMNA (0.45) LMNAPKMTHRBSLC10A6MMP1
SCHEMBL3491639 0.85 THRB (0.48) LMNAPKMTHRBSLC10A6MMP1
SCHEMBL3491636 0.85 THRB (0.48) LMNAPKMTHRBSLC10A6MMP1
SCHEMBL3491642 0.85 THRB (0.48) LMNAPKMTHRBSLC10A6MMP1
SCHEMBL1969473 0.81 THRB (0.48) LMNAPKMTHRBSLC10A6MMP1
SCHEMBL14675926 0.74 CA1 (0.60) PKMTHRBMMP1MMP9MMP13
SCHEMBL30517409 0.74 CA1 (0.60) PKMTHRBMMP1MMP9MMP13
SCHEMBL3917522 0.72 AR (0.67) LMNAPKMTHRBSLC10A6MMP1
SCHEMBL6476661 0.72 LMNA (0.70) LMNAARNPC1HPGDALDH1A1
SCHEMBL8560063 0.71 ALDH1A1 (0.44) GAAALDH1A1

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-8168667-B2 Imidazolidine derivatives, uses therefor, preparation thereof and compositions comprising such GALAPAGOS NV (BE) 2012-05-01 US disclosed
EP-2026799-B1 IMIDAZOLIDINE DERIVATIVES, USES THEREFOR, PREPARATION THEREOF AND COMPOSITIONS COMPRISING SUCH GALAPAGOS SAS (FR) 2011-06-22 EP disclosed