SCHEMBL28468636

SCHEMBL28468636

Cc1ccc(CC(C)Cc2cc[c]cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.38
HCRTR2 O43614 1/20 0.36
ACACB O00763 1/20 0.36
TAAR1 Q96RJ0 3/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2A6 P11509 1/20 0.35
AGXT P21549 2/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
ACHE P22303 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SLC6A2 P23975 2/20 0.32
SLC6A3 Q01959 1/20 0.32

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
SCHEMBL3032392 0.82 SLC6A2 (0.53) IDO1ACACBTAAR1SLC6A2SLC6A3
SCHEMBL2847799 0.80 ESR1 (0.50) IDO1HCRTR2ACACBACHESMN1; SMN2
SCHEMBL9436282 0.78 TRPA1 (0.35) TAAR1CYP2A6SLC6A2SLC6A3
SCHEMBL3080821 0.78 TRPA1 (0.35) TAAR1CYP2A6SLC6A2SLC6A3
SCHEMBL3533774 0.78 IDO1 (0.44) IDO1TAAR1CYP1A2CYP2A6AGXT
SCHEMBL3678427 0.78 CYP1A2 (0.52) IDO1TAAR1CYP1A2CYP2A6AGXT
SCHEMBL8478139 0.78 SLC6A2 (0.37) IDO1ACHETDP1SMN1; SMN2SLC6A2
SCHEMBL19937357 0.78 ESR1 (0.44) IDO1HCRTR2ACACBTAAR1CYP1A2
SCHEMBL26788162 0.77 ACHE (0.56) IDO1TAAR1CYP1A2CYP2A6AGXT
SCHEMBL1306031 0.77 CYP1A2 (0.52) IDO1ACACBTAAR1CYP1A2CYP2A6

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-107614562-B Photocurable composition, cured product using same, and optical component 株式会社大赛璐 2022-06-03 CN disclosed
CN-113728031-A Alicyclic epoxy compound product 株式会社大赛璐 2021-11-30 CN disclosed
CN-113227062-A High purity 3, 4-epoxycyclohexylmethyl methacrylate 株式会社大赛璐 2021-08-06 CN disclosed
CN-111587267-A Alicyclic epoxy compound product 株式会社大赛璐 2020-08-25 CN disclosed