SCHEMBL28374346

SCHEMBL28374346

O=[C]OC1Cc2cccc3cccc1c23

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 9/20 0.41
MTNR1B P49286 9/20 0.41
CYP3A4 P08684 1/20 0.34
TSHR P16473 1/20 0.34
KDM4E B2RXH2 2/20 0.33
OPRM1 P35372 4/20 0.33
OPRK1 P41145 4/20 0.33
OPRL1 P41146 4/20 0.33
OPRD1 P41143 3/20 0.33
ADRA2A P08913 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL28203671 0.77 MTNR1A (0.41) MTNR1AMTNR1BCYP3A4TSHROPRM1
SCHEMBL27777726 0.77 MTNR1A (0.44) MTNR1AMTNR1BCYP3A4TSHRKDM4E
SCHEMBL9517016 0.77 MTNR1A (0.41) MTNR1AMTNR1BCYP3A4TSHRKDM4E
SCHEMBL10267902 0.74 MTNR1A (0.52) MTNR1AMTNR1BKDM4E
SCHEMBL21117245 0.74 MTNR1A (0.46) MTNR1AMTNR1BKDM4EOPRM1OPRK1
SCHEMBL11963888 0.73 MTNR1A (0.46) MTNR1AMTNR1BCYP3A4TSHRKDM4E
SCHEMBL9610270 0.73 MTNR1A (0.41) MTNR1AMTNR1BCYP3A4TSHRKDM4E
SCHEMBL1618606 0.73 MTNR1A (0.38) MTNR1AMTNR1BCYP3A4TSHRKDM4E
SCHEMBL18826331 0.72 MTNR1A (0.47) MTNR1AMTNR1BKDM4E
SCHEMBL16943708 0.72 MTNR1A (0.50) MTNR1AMTNR1BKDM4EOPRM1OPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111722483-A Electrophotographic photoreceptor, process cartridge, and image forming apparatus 富士施乐株式会社 2020-09-29 CN disclosed
CN-110941154-A Electrophotographic photoreceptor, process cartridge, and image forming apparatus 富士施乐株式会社 2020-03-31 CN disclosed