SCHEMBL2841960

SCHEMBL2841960

O=Cc1cccc([S])c1[N+](=O)[O-]

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 4/20 0.50
ALDH1A1 P00352 4/20 0.42
TDP1 Q9NUW8 3/20 0.42
LMNA P02545 2/20 0.41
MEN1 O00255 1/20 0.41
THRB P10828 1/20 0.41
BLM P54132 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPT P10636 1/20 0.37
TSHR P16473 3/20 0.37
GPR35 Q9HC97 1/20 0.37
POLB P06746 1/20 0.35
TRIM24 O15164 1/20 0.34
TRIM33 Q9UPN9 1/20 0.34
CYP3A4 P08684 1/20 0.34

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
SCHEMBL9417632 0.87 ERN1 (0.57) ERN1ALDH1A1TDP1LMNAMEN1
SCHEMBL196088 0.80 ERN1 (0.65) ERN1ALDH1A1TDP1LMNAMEN1
SCHEMBL27985682 0.80 ERN1 (0.50) ERN1ALDH1A1TDP1LMNAMEN1
SCHEMBL27935920 0.80 ERN1 (0.65) ERN1ALDH1A1TDP1LMNAMEN1
SCHEMBL103025 0.78 ERN1 (0.50) ERN1ALDH1A1TDP1LMNAMEN1
SCHEMBL29952992 0.78 ERN1 (0.50) ERN1ALDH1A1TDP1LMNAMEN1
SCHEMBL2625726 0.78 ERN1 (0.49) ERN1ALDH1A1TDP1LMNAMEN1
SCHEMBL2422942 0.78 GPR35 (0.58) ERN1ALDH1A1TDP1LMNAMEN1
SCHEMBL29954426 0.78 ERN1 (0.49) ERN1ALDH1A1TDP1LMNAMEN1
SCHEMBL2366617 0.78 ERN1 (0.49) ERN1ALDH1A1TDP1LMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4337675-A1 ANGIOTENSIN-(1-9) ANALOGUE BASED ON D AMINO ACIDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF Universidad De Chile (CL) 2024-03-20 EP disclosed
EP-2267020-A2 Binding polypeptides for B lymphocyte stimulator protein (BLyS) Human Genome Sciences, Inc. (US) 2010-12-29 EP disclosed
EP-2267017-A2 Binding polypeptides for B lymphocyte stimulator protein (BLyS) Human Genome Sciences, Inc. (US) 2010-12-29 EP disclosed
US-7608681-B2 Methods and compositions for prolonging elimination half-times of bioactive compounds GENENTECH, INC. (US) 2009-10-27 US disclosed
EP-1674477-A2 Binding polypeptides for B lymphocyte stimulator protein (BLYS) Dyax Corp. (US) 2006-06-28 EP disclosed
US-20040253247-A1 Methods and compositions for prolonging elimination half-times of bioactive compounds GENENTECH, INC. 2004-12-16 US disclosed
US-4772684-A HYPOTENSIVE OR HYPERTENSIVE TRITON BIOSCIENCES, INC. (US) 1988-09-20 US disclosed