SCHEMBL9684944

SCHEMBL9684944

CC(=O)SC(=O)CCC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.50
SLC15A2 Q16348 1/20 0.50
EGLN1 Q9GZT9 3/20 0.47
ALKBH5 Q6P6C2 1/20 0.47
SUCNR1 Q9BXA5 1/20 0.47
SLC22A6 Q4U2R8 2/20 0.43
KDM6B O15054 2/20 0.42
KDM5C P41229 2/20 0.42
PHF8 Q9UPP1 2/20 0.42
KDM2A Q9Y2K7 2/20 0.42
KDM4E B2RXH2 1/20 0.42
TSHR P16473 7/20 0.41
NFKB1 P19838 1/20 0.41
PMP22 Q01453 1/20 0.41
AKR1B1 P15121 1/20 0.40
FFAR3 O14843 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC8 Q9BY41 1/20 0.39

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
SCHEMBL2335970 0.83 LMNA (0.60) LMNASLC15A2EGLN1ALKBH5SUCNR1
SCHEMBL11545391 0.77 ALDH1A1 (0.30) ALDH1A1
Succinic Acid SCHEMBL1921951 0.73 EGLN1 (0.75) LMNASLC15A2EGLN1ALKBH5SUCNR1
Succinic Acid SCHEMBL2148509 0.73 EGLN1 (0.75) LMNASLC15A2EGLN1ALKBH5SUCNR1
Succinic Acid SCHEMBL35204 0.73 EGLN1 (0.75) LMNASLC15A2EGLN1ALKBH5SUCNR1
Succinic Acid SCHEMBL16415716 0.73 EGLN1 (0.75) LMNASLC15A2EGLN1ALKBH5SUCNR1
Succinic Acid SCHEMBL17975779 0.73 EGLN1 (0.75) LMNASLC15A2EGLN1ALKBH5SUCNR1
SCHEMBL28409672 0.72
Succinic Acid SCHEMBL2305765 0.70 EGLN1 (0.69) LMNASLC15A2EGLN1ALKBH5SUCNR1
Succinic Acid SCHEMBL10776609 0.70 EGLN1 (0.69) LMNASLC15A2EGLN1ALKBH5SUCNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5162502-A Immunotoxins SANOFI (FR) 1992-11-10 US disclosed
US-5037960-A Antitumor agents SANOFI (FR) 1991-08-06 US disclosed
US-4954638-A ANTIALLERGENS, ANTIINFLAMMATORY MERCK FROSST CANADA, INC. (CA) 1990-09-04 US disclosed
US-4767745-A 1,5-DIFLUORO-2,4-DINITRO BENZENE AND 6-N-MALEIMIDOHEXANOIC ACID CHLORIDE AS COUPLING AGENTS; ANTIALLERGENS, ANTIINFLAMMATORY AGENTS MERCK FROSST CANADA, INC. (CA) 1988-08-30 US disclosed
EP-0179959-A1 Conjugates of leukotrienes with proteins MERCK FROSST CANADA INC. (CA) 1986-05-07 EP disclosed
US-4172207-A Process for mercaptoalkanedicarboxylic acid esters MACK GERRY P 1979-10-23 US disclosed