Isophthalic Acid

Isophthalic Acid

SCHEMBL27488646

CNCc1cccc2ccccc12.O=C(O)c1cccc(C(=O)O)c1

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.54
LMNA P02545 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
RECQL P46063 1/20 0.52
KMT2A Q03164 5/20 0.50
MEN1 O00255 4/20 0.50
MAPT P10636 1/20 0.50
CTNNB1 P35222 1/20 0.49
IFNAR1 P17181 1/20 0.49
TDP1 Q9NUW8 2/20 0.49
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 1/20 0.47
MRGPRX4 Q96LA9 1/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
HPGD P15428 1/20 0.47
PTGER4 P35408 1/20 0.47
MTNR1A P48039 1/20 0.47

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
SCHEMBL29434746 0.82 IFNAR1 (0.66) LMNASMN1; SMN2RECQLKMT2AMEN1
SCHEMBL681401 0.82 IFNAR1 (0.66) LMNASMN1; SMN2RECQLKMT2AMEN1
SCHEMBL5321295 0.82 IFNAR1 (0.66) LMNASMN1; SMN2RECQLKMT2AMEN1
Hydrochloric Acid SCHEMBL1093699 0.81 IFNAR1 (0.64) LMNASMN1; SMN2RECQLKMT2AMEN1
Hydrochloric Acid SCHEMBL6251238 0.81 IFNAR1 (0.64) LMNASMN1; SMN2RECQLKMT2AMEN1
Isophthalic Acid SCHEMBL27656644 0.80 TDP1 (0.53) POLBKMT2AMEN1CTNNB1TDP1
Isophthalic Acid SCHEMBL27280135 0.77 KMT2A (0.63) POLBKMT2AMEN1MAPTKDM4E
Isophthalic Acid SCHEMBL27285729 0.76 KMT2A (0.62) POLBKMT2AMEN1MAPTKDM4E
SCHEMBL3817884 0.75 CA2 (0.70) KMT2AMEN1MAPTCTNNB1TDP1
Isophthalic Acid SCHEMBL27484405 0.75 CA12 (0.64) KMT2AMEN1TDP1MRGPRX4HPGD

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
CN-1197860-C FAB I inhibitors SMITHKLINE BEECHAM CORP (CA) 2005-04-20 CN disclosed
CN-1378542-A Antigen binding fragment I inhibitors SMITHKLINE BEECHAM CORP (US) 2002-11-06 CN disclosed