SCHEMBL6628634

SCHEMBL6628634

CCCCC(CC)CC1=CC=CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.39
TDP1 Q9NUW8 2/20 0.39
CYP3A4 P08684 5/20 0.38
TSHR P16473 4/20 0.38
CA2 P00918 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
GLA P06280 1/20 0.33
HTT P42858 1/20 0.33
KDM4E B2RXH2 1/20 0.33
CHRM2 P08172 1/20 0.32
HTR1A P08908 1/20 0.32
ADRA2A P08913 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
CHRM1 P11229 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
OPRM1 P35372 1/20 0.32
DRD3 P35462 1/20 0.32
SLC6A3 Q01959 1/20 0.32
KCNH2 Q12809 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
SCHEMBL28442444 0.75 OPRM1 (0.33) OPRM1
SCHEMBL28442961 0.74 ACE2 (0.33) OPRM1
SCHEMBL9515325 0.72
SCHEMBL18092322 0.70 ALDH1A1 (0.38) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL284854 0.70
SCHEMBL337597 0.70
SCHEMBL7634517 0.69
SCHEMBL20972451 0.69
SCHEMBL153634 0.69 BDKRB2 (0.48) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL28396536 0.69 HRH3 (0.32)

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116106960-A Radiation detector with laser cut absorber tiles 西门子医疗有限公司 2023-05-12 CN disclosed
CN-106133939-B Organic light emitting apparatus 乐金显示有限公司 2018-01-30 CN disclosed
CN-105980886-A Hybrid organic X-ray detector with conductive channels 西门子公司 2016-09-28 CN disclosed
CN-105829913-A Scintillators comprising an organic photodetection shell 西门子保健有限责任公司 2016-08-03 CN disclosed
CN-105829914-A Conversion film for converting ionizing radiation, radiation detector and method for producing the same 西门子保健有限责任公司 2016-08-03 CN disclosed
EP-0974602-B1 Catalyst and process for hydrogenating olefinically unsaturated compound JSR CORP (JP) 2004-01-02 EP disclosed
US-6291596-B1 CONTACTING OLEFINICALLY UNSATURATED COMPOUND WITH HYDROGEN IN THE PRESENCE OF A HYDROGENATION CATALYST COMPRISING TITANIUM OR ZIRCONIUM OR HAFNIUM COMPOUND IN AN INERT, ORGANIC SOLVENT JSR CORPORATION (JP) 2001-09-18 US disclosed
EP-0974602-A1 Catalyst and process for hydrogenating olefinically unsaturated compound JSR Corporation (JP) 2000-01-26 EP disclosed
US-4329508-A Process for making alkyl cyclopentenones SCM CORPORATION (US) 1982-05-11 US disclosed