SCHEMBL11110672

SCHEMBL11110672

Cc1c(Cl)ccc(C(=O)O)c1Nc1ccccc1C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 3/20 0.68
MEN1 O00255 3/20 0.68
PTGS2 P35354 3/20 0.68
AKR1C3 P42330 3/20 0.68
KMT2A Q03164 3/20 0.68
ADORA3 P0DMS8 2/20 0.68
LMNA P02545 2/20 0.68
CYP1A2 P05177 2/20 0.68
CYP3A4 P08684 2/20 0.68
CYP2C9 P11712 2/20 0.68
HIF1A Q16665 2/20 0.68
USP2 O75604 1/20 0.68
MT-CO2 P00403 1/20 0.68
PLA2G1B P04054 1/20 0.68
PGR P06401 1/20 0.68
HTR1A P08908 1/20 0.68
ADRA2A P08913 1/20 0.68
AR P10275 1/20 0.68
MAPT P10636 1/20 0.68
HPGD P15428 1/20 0.68

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
SCHEMBL11106473 0.84 AKR1C3 (0.67) TTRMEN1PTGS2AKR1C3KMT2A
SCHEMBL28286415 0.84 MEN1 (0.51) TTRMEN1PTGS2AKR1C3KMT2A
SCHEMBL14234727 0.83 AKR1C3 (0.58) TTRMEN1PTGS2AKR1C3KMT2A
SCHEMBL3064448 0.82 TTR (0.73) TTRMEN1PTGS2AKR1C3KMT2A
Tolfenamic Acid SCHEMBL25190 0.81 MT-CO2 (1.00) TTRMEN1PTGS2AKR1C3KMT2A
Tolfenamic Acid SCHEMBL8060884 0.81 MT-CO2 (1.00) TTRMEN1PTGS2AKR1C3KMT2A
Tolfenamic Acid SCHEMBL29389998 0.81 MT-CO2 (1.00) TTRMEN1PTGS2AKR1C3KMT2A
Tolfenamic Acid SCHEMBL29484181 0.81 MT-CO2 (1.00) TTRMEN1PTGS2AKR1C3KMT2A
Meclofenamic Acid SCHEMBL106 0.81 PTGS2 (1.00) TTRMEN1PTGS2AKR1C3KMT2A
Meclofenamic Acid SCHEMBL11543781 0.81 PTGS2 (1.00) TTRMEN1PTGS2AKR1C3KMT2A

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-4447453-A 2,2'-IMINODIBENZOIC ACID CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 1984-05-08 US claimed
US-4092426-A LIVER DISORDERS CHUGAI SEIYAKU KABUSHIKI KAISHA (JA) 1978-05-30 US disclosed