SCHEMBL28816846

SCHEMBL28816846

CCC(C(=O)c1ccccc1)C1CNCCO1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 13/20 0.46
SLC6A4 P31645 12/20 0.46
SLC6A3 Q01959 7/20 0.46
MLNR O43193 1/20 0.46
ADRB2 P07550 1/20 0.46
CHRM2 P08172 1/20 0.46
CHRM1 P11229 1/20 0.46
CHRM3 P20309 1/20 0.46
HTR2C P28335 1/20 0.46
OPRK1 P41145 1/20 0.46
KCNH2 Q12809 1/20 0.46
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
MAPK1 P28482 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL27660034 0.82 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3MLNRADRB2
SCHEMBL27125583 0.80 SLC6A2 (0.39) SLC6A2SLC6A4SLC6A3MLNRADRB2
SCHEMBL28724023 0.76 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3MLNRADRB2
SCHEMBL27619774 0.76 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3MLNRADRB2
SCHEMBL31293284 0.75 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3MLNRADRB2
SCHEMBL7695921 0.74 SLC6A2 (0.51) SLC6A2SLC6A4SLC6A3MLNRADRB2
SCHEMBL11181290 0.73 SLC6A2 (0.56) SLC6A2SLC6A4SLC6A3MLNRADRB2
SCHEMBL29084651 0.72 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3MLNRADRB2
SCHEMBL28915569 0.71 SLC6A2 (0.53) SLC6A2SLC6A4SLC6A3MLNRADRB2
Benzoic Acid SCHEMBL11711296 0.71 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3ADRB2

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-116635789-A Transfer material and method for producing laminate 富士胶片株式会社 2023-08-22 CN disclosed
CN-116360208-A Photosensitive transfer material for vapor deposition mask production and method for producing vapor deposition mask 富士胶片株式会社 2023-06-30 CN disclosed
CN-104245287-B There is composite material vessel and the manufacture method thereof of gas barrier liner 陶氏环球技术有限责任公司 2016-10-26 CN disclosed
CN-104245287-A Composite vessel with gas barrier liner and method for its manufacture DOW GLOBAL TECHNOLOGIES LLC 2014-12-24 CN disclosed