SCHEMBL6580184

SCHEMBL6580184

CC(C)Oc1ccc(C(=O)Nc2cccc(C(=O)CO)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 6/20 0.58
KCNK9 Q9NPC2 1/20 0.54
HTT P42858 3/20 0.54
LMNA P02545 3/20 0.54
PKM P14618 2/20 0.54
POLB P06746 1/20 0.54
RECQL P46063 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
NPC1 O15118 3/20 0.53
MAPT P10636 3/20 0.53
RAB9A P51151 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
KMT2A Q03164 4/20 0.53
MEN1 O00255 3/20 0.53
GAA P10253 1/20 0.53
MAPK14 Q16539 1/20 0.53
SMO Q99835 1/20 0.53
ALDH1A1 P00352 3/20 0.52
TP53 P04637 3/20 0.52
KDM4E B2RXH2 1/20 0.52

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
SCHEMBL6580034 0.87 KCNK9 (0.72) KCNK9PKMNPC1RAB9ASMN1; SMN2
SCHEMBL6579950 0.85 NPC1 (0.73) NR1H4LMNANPC1MAPTRAB9A
SCHEMBL6580158 0.84 KMT2A (0.54) NR1H4KCNK9HTTLMNAPKM
SCHEMBL6577705 0.82 NR1H4 (0.78) NR1H4LMNANPC1MAPTRAB9A
SCHEMBL6580077 0.82 NR1H4 (0.70) NR1H4NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL6580248 0.82 NR1H4 (0.57) NR1H4KCNK9POLBNPC1MAPT
SCHEMBL7477030 0.82 NR1H4 (0.52) NR1H4KCNK9HTTTDP1NPC1
SCHEMBL6346822 0.82 KCNK3 (0.71) KCNK9HTTPOLBNPC1MAPT
SCHEMBL6582800 0.81 KCNK9 (0.64) KCNK9PKMNPC1RAB9ASMN1; SMN2
SCHEMBL27916078 0.80 KMT2A (0.55) HTTLMNATDP1NPC1RAB9A

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