SCHEMBL28655414

SCHEMBL28655414

O=C1CCc2cc(-c3ccc4c(c3)CCC4=O)ccc21

nearest known ligand 0.78

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 5/20 0.78
CYP1A2 P05177 1/20 0.66
CYP11B1 P15538 1/20 0.66
CYP11B2 P19099 1/20 0.66
CASP1 P29466 1/20 0.63
CASP7 P55210 1/20 0.63
HSD17B10 Q99714 1/20 0.63
PGR P06401 2/20 0.53
GRM5 P41594 1/20 0.52
MAOB P27338 2/20 0.48
MAOA P21397 1/20 0.48
PRKCI P41743 1/20 0.48
PBRM1 Q86U86 1/20 0.47
PARP10 Q53GL7 1/20 0.46
PARP11 Q9NR21 1/20 0.46
GRM1 Q13255 1/20 0.43
HRH3 Q9Y5N1 2/20 0.42
MKNK1 Q9BUB5 1/20 0.42

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
SCHEMBL1745161 0.90 HSD17B1 (0.71) HSD17B1CYP1A2CYP11B1CYP11B2CASP1
SCHEMBL1747435 0.88 HSD17B1 (0.69) HSD17B1CYP1A2CYP11B1CYP11B2CASP1
SCHEMBL1745120 0.88 HSD17B1 (0.69) HSD17B1CYP1A2CYP11B1CYP11B2CASP1
SCHEMBL30456099 0.88 HSD17B1 (0.65) HSD17B1CYP1A2CYP11B1CYP11B2CASP1
SCHEMBL28655417 0.88 HSD17B1 (0.65) HSD17B1CYP1A2CYP11B1CYP11B2CASP1
SCHEMBL1746656 0.88 HSD17B1 (0.69) HSD17B1CYP1A2CYP11B1CYP11B2CASP1
SCHEMBL1030949 0.88 HSD17B1 (1.00) HSD17B1CYP1A2CYP11B1CYP11B2CASP1
SCHEMBL19100757 0.87 HSD17B1 (0.62) HSD17B1CYP1A2CYP11B1CYP11B2CASP1
SCHEMBL3986077 0.87 HSD17B1 (0.62) HSD17B1CYP1A2CYP11B1CYP11B2CASP1
SCHEMBL3987535 0.87 HSD17B1 (0.62) HSD17B1CYP1A2CYP11B1CYP11B2CASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113651784-B Synthesis method of 3,3', 4' -biphenyl tetracarboxylic dianhydride 大连新阳光材料科技有限公司 2023-05-30 CN claimed
CN-113651784-B Synthesis method of 3,3', 4' -biphenyl tetracarboxylic dianhydride 大连新阳光材料科技有限公司 2023-05-30 CN disclosed
CN-113651784-B Synthesis method of 3,3', 4' -biphenyl tetracarboxylic dianhydride 大连新阳光材料科技有限公司 2023-05-30 CN disclosed
CN-113651784-A Synthetic method of 3,3',4,4' -biphenyl tetracarboxylic dianhydride 大连新阳光材料科技有限公司 2021-11-16 CN disclosed