SCHEMBL29929943

SCHEMBL29929943

COc1cccc(Oc2cccc(Oc3cccc(OC)c3)c2)c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.72
ACHE P22303 1/20 0.61
ALDH1A1 P00352 4/20 0.58
CYP3A4 P08684 2/20 0.58
CA1 P00915 1/20 0.58
CA2 P00918 1/20 0.58
CA7 P43166 1/20 0.58
CA9 Q16790 1/20 0.58
LTA4H P09960 1/20 0.56
MTNR1B P49286 3/20 0.56
MTNR1A P48039 2/20 0.56
KDM4E B2RXH2 2/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
BRCA1 P38398 1/20 0.53
HBB P68871 1/20 0.53
HSD17B10 Q99714 1/20 0.53
POLB P06746 1/20 0.53
CA4 P22748 1/20 0.52
MITF O75030 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
SCHEMBL13167638 1.00 SMN1; SMN2 (0.72) SMN1; SMN2ACHEALDH1A1CYP3A4CA1
SCHEMBL1061713 1.00 SMN1; SMN2 (0.72) SMN1; SMN2ACHEALDH1A1CYP3A4CA1
SCHEMBL30053231 1.00 SMN1; SMN2 (0.72) SMN1; SMN2ACHEALDH1A1CYP3A4CA1
SCHEMBL10709191 0.95 SMN1; SMN2 (0.80) SMN1; SMN2ACHEALDH1A1CYP3A4CA1
SCHEMBL11049862 0.93 SMN1; SMN2 (0.77) SMN1; SMN2ACHEALDH1A1CA1CA2
SCHEMBL491308 0.93 SMN1; SMN2 (0.70) SMN1; SMN2ACHEALDH1A1CYP3A4CA1
1,3-Dimethoxybenzene SCHEMBL9350 0.91 ACHE (0.70) SMN1; SMN2ACHEALDH1A1CYP3A4CA1
1,3-Dimethoxybenzene SCHEMBL901285 0.91 ACHE (0.70) SMN1; SMN2ACHEALDH1A1CYP3A4CA1
SCHEMBL4608736 0.90 SMN1; SMN2 (0.73) SMN1; SMN2ACHEALDH1A1CA1CA2
SCHEMBL15695543 0.89 ACHE (0.83) SMN1; SMN2ACHEALDH1A1CYP3A4CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119954746-A Epoxy resin 波音公司 2025-05-09 CN disclosed
CN-115057991-A Epoxy resin 波音公司 2022-09-16 CN disclosed