Indole-2-Carboxylic Acid

Indole-2-Carboxylic Acid

SCHEMBL7590299

Nc1ccc(N)cc1.O=C(O)c1cc2ccccc2[nH]1

nearest known ligand 0.83

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.83
HSD17B10 Q99714 4/20 0.83
HPGD P15428 3/20 0.83
MAPT P10636 1/20 0.83
DAO P14920 1/20 0.83
SRD5A2 P31213 1/20 0.83
FLT3 P36888 4/20 0.62
ALDH1A1 P00352 4/20 0.58
GAA P10253 2/20 0.58
MAPK1 P28482 2/20 0.58
LMNA P02545 3/20 0.55
IDO1 P14902 1/20 0.55
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
SMAD3 P84022 1/20 0.53
KMT2A Q03164 2/20 0.53
CYP2C19 P33261 2/20 0.51
F7 P08709 1/20 0.51
F3 P13726 1/20 0.51

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
Indole-2-Carboxylic Acid SCHEMBL7590292 0.91 KDM4E (0.69) KDM4EHSD17B10HPGDMAPTDAO
Indole-2-Carboxylic Acid SCHEMBL1935 0.91 KDM4E (1.00) KDM4EHSD17B10HPGDMAPTDAO
Indole-2-Carboxylic Acid SCHEMBL29395165 0.91 KDM4E (1.00) KDM4EHSD17B10HPGDMAPTDAO
Indole-2-Carboxylic Acid SCHEMBL9514556 0.89 KDM4E (0.96) KDM4EHSD17B10HPGDMAPTDAO
Indole-2-Carboxylic Acid SCHEMBL3297085 0.89 KDM4E (0.96) KDM4EHSD17B10HPGDMAPTDAO
Indole-2-Carboxylic Acid SCHEMBL5243668 0.89 KDM4E (0.96) KDM4EHSD17B10HPGDMAPTDAO
Indole-2-Carboxylic Acid SCHEMBL11743045 0.89 KDM4E (0.96) KDM4EHSD17B10HPGDMAPTDAO
Indole-2-Carboxylic Acid SCHEMBL5243678 0.89 KDM4E (0.96) KDM4EHSD17B10HPGDMAPTDAO
Indole-2-Carboxylic Acid SCHEMBL31620677 0.89 KDM4E (0.96) KDM4EHSD17B10HPGDMAPTDAO
Indole-2-Carboxylic Acid SCHEMBL28178562 0.89 KDM4E (0.96) KDM4EHSD17B10HPGDMAPTDAO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1144399-A3 HETEROCYCLIC CARBOXAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING A SUBSTITUTED PHENYLENEDIAMINE GROUP Wyeth (US) 2002-09-11 EP disclosed
EP-1144397-A3 HETEROCYCLIC CARBOXAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING PHENYLENEDIAMINE GROUP Wyeth (US) 2002-09-11 EP disclosed
EP-1144399-A2 HETEROCYCLIC CARBOXAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING A SUBSTITUTED PHENYLENEDIAMINE GROUP AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-17 EP disclosed
EP-1144397-A2 HETEROCYCLIC CARBOXAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING PHENYLENEDIAMINE GROUP AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-17 EP disclosed
EP-1140913-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-10 EP disclosed
EP-1137645-A2 ALPHA-METHYLBENZYL-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING A PHENYLENEDIAMINE GROUP AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-04 EP disclosed
EP-1137632-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-04 EP disclosed
EP-1137647-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-04 EP disclosed
EP-1137633-A2 ACETAMIDE AND SUBSTITUTED ACETAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-04 EP disclosed
WO-2000034260-A2 ALPHA-METHYLBENZYL-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING A PHENYLENEDIAMINE GROUP AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed
WO-2000034269-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed
WO-2000034261-A2 HETEROCYCLIC CARBOXAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING A SUBSTITUTED PHENYLENEDIAMINE GROUP AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed
WO-2000034238-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed
WO-2000034268-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed
WO-2000034237-A2 ACETAMIDE AND SUBSTITUTED ACETAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed
WO-2000034258-A2 HETEROCYCLIC CARBOXAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING PHENYLENEDIAMINE GROUP AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed