SCHEMBL28814019

SCHEMBL28814019

CCCC1Cc2cccc3cccc(c23)C1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FYN P06241 1/20 0.48
MTNR1A P48039 10/20 0.43
MTNR1B P49286 10/20 0.43
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
IDO1 P14902 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
SCHEMBL3916886 0.81 FYN (0.57) FYNMTNR1AMTNR1BIDO1
SCHEMBL15967875 0.74 CYP3A4 (0.48) MTNR1AMTNR1BCYP3A4TSHR
SCHEMBL10615467 0.73 DRD2 (0.52) MTNR1AMTNR1B
SCHEMBL26967539 0.72 FYN (0.75) FYNIDO1
SCHEMBL10533911 0.72 DRD2 (0.48) MTNR1AMTNR1B
SCHEMBL10533962 0.72 DRD3 (0.50)
Hydrochloric Acid SCHEMBL10615414 0.72 DRD3 (0.69) FYN
Hydrochloric Acid SCHEMBL10618237 0.72 DRD2 (0.51) MTNR1AMTNR1B
Hydrochloric Acid SCHEMBL10616548 0.70 DRD2 (0.47) MTNR1AMTNR1B
Hydrochloric Acid SCHEMBL10618356 0.70 DRD3 (0.49)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106103084-A Feature stacked film, the manufacture method of feature stacked film and the Organnic electroluminescent device comprising feature stacked film 富士胶片株式会社 2016-11-09 CN disclosed
CN-104203563-B Gas barrier film 富士胶片株式会社 2016-08-24 CN disclosed
CN-104203563-A Gas barrier film FUJI PHOTO FILM CO LTD 2014-12-10 CN disclosed