SCHEMBL30059639

SCHEMBL30059639

NC1CCc2c(F)cc(F)cc2C1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.59
DRD3 P35462 5/20 0.59
MAPT P10636 2/20 0.43
NFKB1 P19838 1/20 0.43
THPO P40225 1/20 0.43
HIF1A Q16665 1/20 0.43
HSD17B10 Q99714 1/20 0.43
USP2 O75604 1/20 0.43
ALDH1A1 P00352 1/20 0.43
KDM4E B2RXH2 1/20 0.42
PLAU P00749 1/20 0.41
OPRK1 P41145 1/20 0.40
ADRA1A P35348 1/20 0.36

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
SCHEMBL6958473 1.00 DRD2 (0.59) DRD2DRD3MAPTNFKB1THPO
SCHEMBL3316692 1.00 DRD2 (0.59) DRD2DRD3MAPTNFKB1THPO
SCHEMBL30057164 1.00 DRD2 (0.59) DRD2DRD3MAPTNFKB1THPO
SCHEMBL754233 1.00 DRD2 (0.59) DRD2DRD3MAPTNFKB1THPO
SCHEMBL30058138 1.00 DRD2 (0.59) DRD2DRD3MAPTNFKB1THPO
Hydrochloric Acid SCHEMBL754377 0.98 DRD2 (0.57) DRD2DRD3MAPTNFKB1THPO
Bromide SCHEMBL30426257 0.98 DRD2 (0.57) DRD2DRD3MAPTNFKB1THPO
Hydrochloric Acid SCHEMBL754376 0.98 DRD2 (0.57) DRD2DRD3MAPTNFKB1THPO
Bromide SCHEMBL29016368 0.98 DRD2 (0.57) DRD2DRD3MAPTNFKB1THPO
Hydrochloric Acid SCHEMBL30059645 0.98 DRD2 (0.57) DRD2DRD3MAPTNFKB1THPO

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-117867045-A Method for synthesizing (S) -5, 7-difluoro-1, 2,3, 4-tetrahydronaphthalene-2-amine by biological enzyme method 中国科学院青岛生物能源与过程研究所 2024-04-12 CN claimed
CN-113527108-B Process for preparing optically pure 5, 7-difluoro-1, 2,3, 4-tetrahydronaphthalen-2-amine and salts thereof 斯芬克司药物研发(天津)股份有限公司 2022-10-25 CN disclosed
CN-113527108-B Process for preparing optically pure 5, 7-difluoro-1, 2,3, 4-tetrahydronaphthalen-2-amine and salts thereof 斯芬克司药物研发(天津)股份有限公司 2022-10-25 CN disclosed
CN-113527108-B Process for preparing optically pure 5, 7-difluoro-1, 2,3, 4-tetrahydronaphthalen-2-amine and salts thereof 斯芬克司药物研发(天津)股份有限公司 2022-10-25 CN disclosed