SCHEMBL6582001

SCHEMBL6582001

COc1ccc(Cn2nnnc2C(=O)O)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERCC5 P28715 1/20 0.65
FEN1 P39748 1/20 0.65
ALDH1A1 P00352 7/20 0.54
HTT P42858 2/20 0.54
LMNA P02545 2/20 0.53
PKM P14618 1/20 0.49
ALOX15 P16050 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
TOP2A P11388 1/20 0.47
PDE8B O95263 1/20 0.46
TP53 P04637 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
GFER P55789 1/20 0.46
RAB9A P51151 1/20 0.46
AKR1C3 P42330 2/20 0.46
GAA P10253 1/20 0.46
TSHR P16473 1/20 0.46
HSD11B1 P28845 1/20 0.45
USP2 O75604 1/20 0.45

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
SCHEMBL11063190 0.89 ERCC5 (0.62) ERCC5FEN1ALDH1A1HTTLMNA
SCHEMBL10757841 0.87 ERCC5 (0.61) ERCC5FEN1ALDH1A1HTTLMNA
Potassium Ion SCHEMBL9865996 0.86 ERCC5 (0.60) ERCC5FEN1ALDH1A1HTTLMNA
SCHEMBL11280678 0.86 ERCC5 (0.60) ERCC5FEN1ALDH1A1HTTLMNA
SCHEMBL5912674 0.84 ERCC5 (0.57) ERCC5FEN1ALDH1A1HTTLMNA
SCHEMBL6580167 0.82 ERCC5 (0.45) ERCC5FEN1ALDH1A1HTTLMNA
SCHEMBL6577327 0.82 HPGD (0.54) ERCC5FEN1ALDH1A1LMNAPKM
SCHEMBL6580310 0.81 HDAC6 (0.45) ERCC5FEN1ALDH1A1HTTLMNA
SCHEMBL6501472 0.81 ALDH1A1 (0.59) ERCC5FEN1ALDH1A1HTTLMNA
SCHEMBL11271744 0.80 HPGD (0.53) ERCC5FEN1ALDH1A1LMNAPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0716088-B1 PROCESS FOR PRODUCING 2-(TETRAZOL-5-YL)-4-OXO-4H-BENZOPYRANS SUMITOMO CHEMICAL CO (JP) 2004-02-18 EP disclosed
US-5597929-A Production process of 2-(tetrazol-5-yl)-4-oxo-4H-benzopyran SUMITOMO CHEMICAL CO., LTD. (JP) 1997-01-28 US disclosed
EP-0716088-A1 PROCESS FOR PRODUCING 2-(TETRAZOL-5-YL)-4-OXO-4H-BENZOPYRANS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-06-12 EP disclosed
EP-0222961-B1 RESORCINOL ETHERS CIBA-GEIGY AG (CH) 1989-09-20 EP disclosed
US-4863942-A Novel resorcinol ethers and anti-inflammatory and anti-allergic use thereof CIBA-GEIGY CORPORATION (US) 1989-09-05 US disclosed
US-4808604-A LEUKOTRIENE ANTAGONISTS; BRONCHODILATORS; ANTICOAGULANTS; ANTIINFLAMINETORY AGENTS CIBA-GEIGY CORPORATION (US) 1989-02-28 US disclosed
US-4442115-A ANTI-ASTHMA MAY & BAKER LIMITED (GB) 1984-04-10 US disclosed