SCHEMBL7708092

SCHEMBL7708092

C(=Cc1ccccc1)CC1CNCCO1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 11/20 0.45
SLC6A3 Q01959 8/20 0.45
SLC6A4 P31645 6/20 0.45
ADRB2 P07550 1/20 0.45
HTR1A P08908 1/20 0.45
HTR2A P28223 1/20 0.45
ADRA1A P35348 1/20 0.45
HTR2B P41595 1/20 0.45
ADRA2C P18825 1/20 0.45
ALDH1A1 P00352 3/20 0.44
MAPT P10636 2/20 0.41
POLB P06746 1/20 0.39
HPGD P15428 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
GSTP1 P09211 1/20 0.38

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
SCHEMBL7708087 1.00 SLC6A2 (0.45) SLC6A2SLC6A3SLC6A4ADRB2HTR1A
SCHEMBL436302 0.77 ALDH1A1 (0.46) HTR2AALDH1A1MAPTPOLBHPGD
SCHEMBL4452279 0.75 ALDH1A1 (0.59) ADRA2CALDH1A1MAPTHPGDMEN1
SCHEMBL9137944 0.75 ALDH1A1 (0.46) ADRA2CALDH1A1MAPTPOLBHPGD
SCHEMBL11576674 0.73 MAPT (0.42) SLC6A2SLC6A3SLC6A4HTR2AALDH1A1
SCHEMBL11578335 0.73 MAPT (0.42) SLC6A2SLC6A3SLC6A4HTR2AALDH1A1
SCHEMBL11576668 0.73 MAPT (0.42) SLC6A2SLC6A3SLC6A4HTR2AALDH1A1
SCHEMBL11578336 0.73 MAPT (0.42) SLC6A2SLC6A3SLC6A4HTR2AALDH1A1
SCHEMBL682819 0.72 SLC6A2 (0.50) SLC6A2SLC6A3SLC6A4ADRB2HTR1A
SCHEMBL659743 0.72 SLC6A2 (0.50) SLC6A2SLC6A3SLC6A4ADRB2HTR1A

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-109563196-B Process for producing modified rubber by anionic solution polymerization, rubber composition comprising said rubber and use thereof 公共型股份公司希布尔控股 2021-07-27 CN disclosed
US-6359174-B1 REACTING ALLYL REACTANT WITH ACID CHLORIDE IN PRESENCE OF LEWIS ACID CATALYST THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2002-03-19 US disclosed
US-4705553-A Method of reducing plant growth height using phenylalkylmorpholines BASF AKTIENGESELLSCHAFT (DE) 1987-11-10 US disclosed
US-4434165-A Fungicidal compositions HOFFMANN-LA ROCHE INC. (US) 1984-02-28 US disclosed