SCHEMBL27353149

SCHEMBL27353149

O=C(CO)Oc1ccc2c(c1)OCC=C2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STS P08842 1/20 0.55
CA2 P00918 5/20 0.42
CA5A P35218 5/20 0.42
MAPT P10636 4/20 0.34
TSHR P16473 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
LMNA P02545 2/20 0.33
ALOX5 P09917 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 3/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
TP53 P04637 1/20 0.32
POLB P06746 1/20 0.32
MEN1 O00255 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ALOX15 P16050 1/20 0.32
ALDH1A1 P00352 2/20 0.31
FKBP1A P62942 1/20 0.31
KDM4E B2RXH2 1/20 0.30
NPC1 O15118 1/20 0.30

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
SCHEMBL30421522 0.87 STS (0.53) STSCA2CA5AMAPTALOX5
SCHEMBL31454926 0.80 STS (0.55) STSCA2CA5AMAPTLMNA
SCHEMBL31678265 0.79 STS (0.53) STSCA2CA5ANPSR1LMNA
SCHEMBL31190208 0.79 STS (0.53) STSCA2CA5ANPSR1LMNA
SCHEMBL28363239 0.74 LMNA (0.56) MAPTTSHRNPSR1LMNAGAA
SCHEMBL28445528 0.73 STS (0.60) STSCA2CA5AMAPTLMNA
SCHEMBL29634256 0.73 STS (0.60) STSCA2CA5AMAPTLMNA
SCHEMBL27397632 0.73 STS (0.60) STSCA2CA5A
SCHEMBL31632711 0.73 MAPT (0.39) STSCA2CA5AMAPTTSHR
SCHEMBL10350247 0.72 CA2 (0.47) STSCA2CA5AMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1050364-C 7-glycosyloxybenzopyran derivative and antiallergic agent containing the derivative as active ingredient DAINIPPON INK & CHEMICALS (JP) 2000-03-15 CN claimed
CN-1124738-A 7-glycosyloxybenzopyran derivative and antiallergic agent containing the derivative as active ingredient DAINIPPON INK & CHEMICALS (JP) 1996-06-19 CN claimed
CN-1101678-C Benzopyran derivative and therapeutic agent for heart disease containing the same as active ingredient DAINIPPON INK & CHEMICALS (JP) 2003-02-19 CN disclosed
CN-1050364-C 7-glycosyloxybenzopyran derivative and antiallergic agent containing the derivative as active ingredient DAINIPPON INK & CHEMICALS (JP) 2000-03-15 CN disclosed
CN-1164999-A Benzopyran derivative and therapeutic agent for heart disease containing the same as active ingredient DAINIPPON INK & CHEMICALS (JP) 1997-11-19 CN disclosed
CN-1124738-A 7-glycosyloxybenzopyran derivative and antiallergic agent containing the derivative as active ingredient DAINIPPON INK & CHEMICALS (JP) 1996-06-19 CN disclosed