SCHEMBL6577532

SCHEMBL6577532

O=C(O)c1nnnn1C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.33
POLB P06746 3/20 0.33
ALDH1A1 P00352 4/20 0.33
MAPT P10636 3/20 0.33
KMT2A Q03164 2/20 0.33
HTT P42858 2/20 0.33
MEN1 O00255 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
HPGD P15428 3/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
CA14 Q9ULX7 1/20 0.31
GAA P10253 1/20 0.31
KDM4C Q9H3R0 1/20 0.31
HSD11B1 P28845 1/20 0.31
CCR6 P51684 1/20 0.31

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
SCHEMBL8925499 0.87 HSD11B1 (0.43) CYP1A2ALDH1A1HTTCA1CA2
SCHEMBL5365776 0.79 TP53 (0.45) CYP1A2ALDH1A1MAPTKMT2AHTT
SCHEMBL2164161 0.76 KDM4C (0.40) POLBALDH1A1HPGDKDM4CHSD11B1
SCHEMBL7195878 0.75 LMNA (0.43) POLBALDH1A1MAPTHTTHPGD
SCHEMBL29268367 0.74 HTT (0.38) CYP1A2ALDH1A1MAPTKMT2AHTT
SCHEMBL8999171 0.73 CES2 (0.36) CYP1A2POLBALDH1A1KMT2AHTT
SCHEMBL8999168 0.73 CES2 (0.36) CYP1A2POLBALDH1A1KMT2AHTT
SCHEMBL6720540 0.73 ALDH1A1 (0.35) CYP1A2POLBALDH1A1MAPTKMT2A
SCHEMBL29540039 0.73 NPSR1 (0.36) CYP1A2POLBALDH1A1KMT2AHTT
SCHEMBL12787567 0.73 ALDH1A1 (0.39) POLBALDH1A1MAPTKMT2AHTT

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 3 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