5-Chloroindole-2-Carboxylic Acid

5-Chloroindole-2-Carboxylic Acid

SCHEMBL6162690

CNC(N)=O.O=C(O)c1cc2cc(Cl)ccc2[nH]1

nearest known ligand 0.77

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F7 P08709 1/20 0.77
F3 P13726 1/20 0.77
MEN1 O00255 1/20 0.56
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56
KMT2A Q03164 1/20 0.56
NHERF1 O14745 3/20 0.55
PIN1 Q13526 1/20 0.55
ALOX15 P16050 1/20 0.54
SMAD3 P84022 1/20 0.53
FLT3 P36888 1/20 0.52
PYGL P06737 2/20 0.52
KDM4E B2RXH2 1/20 0.51
PDPK1 O15530 1/20 0.51
ALDH1A1 P00352 1/20 0.51
LMNA P02545 1/20 0.51
HPGD P15428 1/20 0.51
TSHR P16473 1/20 0.51
NFKB1 P19838 1/20 0.51
APEX1 P27695 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
5-Chloroindole-2-Carboxylic Acid SCHEMBL720582 0.88 F7 (1.00) F7F3MEN1NPC1RAB9A
5-Chloroindole-2-Carboxylic Acid SCHEMBL6921825 0.86 F7 (0.96) F7F3MEN1NPC1RAB9A
5-Chloroindole-2-Carboxylic Acid SCHEMBL27410586 0.82 F7 (0.82) F7F3MEN1NPC1RAB9A
SCHEMBL12101200 0.82 ALOX15 (0.77) F7F3MEN1NPC1RAB9A
SCHEMBL764543 0.80 F7 (0.72) F7F3MEN1NPC1RAB9A
SCHEMBL7877880 0.80 F7 (0.55) F7F3MEN1NPC1RAB9A
Hydrochloric Acid SCHEMBL7873363 0.79 F7 (0.54) F7F3MEN1NPC1RAB9A
SCHEMBL2729831 0.77 F7 (0.72) F7F3MEN1NPC1RAB9A
SCHEMBL3963537 0.76 F7 (0.66) F7F3MEN1NPC1RAB9A
SCHEMBL3499567 0.76 F7 (0.76) F7F3MEN1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1134213-B1 Process for the preparation of substituted N-(indole-2-carbonyl)- glycinamides PFIZER (US) 2005-11-02 EP disclosed
EP-0832065-B1 SUBSTITUTED N-(INDOLE-2-CARBONYL)-GLYCINAMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER (US) 2001-10-10 EP disclosed
EP-1134213-A2 Process for the preparation of substituted N-(indole-2-carbonyl)- glycinamides PFIZER INC. (US) 2001-09-19 EP disclosed
US-6277877-B1 GLYCOGEN PHOSPHORYLASE INHIBITOR; ANTIDIABETIC AGENTS PFIZER, INC. 2001-08-21 US disclosed
US-6107329-A HYPOTENSIVE AGENTS; CARDIOVASCULAR DISORDERS PFIZER, INC. (US) 2000-08-22 US disclosed