SCHEMBL29508231

SCHEMBL29508231

c1ccc2c3c(ccc2c1)CCC3

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.46
CYP2A6 P11509 2/20 0.46
TSHR P16473 2/20 0.46
ALDH1A1 P00352 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
KIF11 P52732 1/20 0.44
HPRT1 P00492 1/20 0.42
ANPEP P15144 1/20 0.42
CYP1A2 P05177 2/20 0.42
KDM4E B2RXH2 1/20 0.42
GLA P06280 1/20 0.42
CYP2C9 P11712 1/20 0.42
HPGD P15428 1/20 0.42
CYP2C19 P33261 1/20 0.42
SIRT1 Q96EB6 1/20 0.42
HIF1A Q16665 1/20 0.39
CYP1B1 Q16678 1/20 0.39
BCHE P06276 1/20 0.39

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
SCHEMBL597361 1.00 HSD17B10 (0.46) HSD17B10CYP2A6TSHRALDH1A1TDP1
SCHEMBL29853815 0.96 KIF11 (0.49) HSD17B10CYP2A6TSHRALDH1A1TDP1
SCHEMBL322439 0.96 KIF11 (0.49) HSD17B10CYP2A6TSHRALDH1A1TDP1
SCHEMBL28753848 0.94 KIF11 (0.47) HSD17B10CYP2A6TSHRALDH1A1TDP1
SCHEMBL29554780 0.90 HPRT1 (0.54) HSD17B10CYP2A6TSHRALDH1A1TDP1
SCHEMBL29580834 0.90 HPRT1 (0.54) HSD17B10CYP2A6TSHRALDH1A1TDP1
SCHEMBL1826535 0.90 HPRT1 (0.54) HSD17B10CYP2A6TSHRALDH1A1TDP1
SCHEMBL54652 0.86 ALDH1A1 (0.50) HSD17B10CYP2A6TSHRALDH1A1TDP1
SCHEMBL29481017 0.86 ALDH1A1 (0.50) HSD17B10CYP2A6TSHRALDH1A1TDP1
SCHEMBL2089665 0.86 HPRT1 (0.54) HSD17B10CYP2A6TSHRALDH1A1TDP1

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
WO-2023190218-A1 DISPLAY DEVICE AND PHOTOSENSITIVE COMPOSITION 東レ株式会社 2023-10-05 WO disclosed
CN-115679467-A Uniform filled yarn 帝斯曼知识产权资产管理有限公司 2023-02-03 CN disclosed
CN-115595694-A Uniform filled yarn 帝斯曼知识产权资产管理有限公司(NL) 2023-01-13 CN disclosed
CN-110892099-B Uniform filled yarn 帝斯曼知识产权资产管理有限公司 2022-11-29 CN disclosed
CN-110892098-B Uniform filled yarn 帝斯曼知识产权资产管理有限公司 2022-11-04 CN disclosed
WO-2022070946-A1 PHOTOSENSITIVE RESIN COMPOSITION, CURED PRODUCT, DISPLAY DEVICE, AND METHOD FOR PRODUCING CURED PRODUCT 東レ株式会社 2022-04-07 WO disclosed