SCHEMBL5010976

SCHEMBL5010976

CCCc1c[c]c(-c2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
PKM P14618 1/20 0.36
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
SIGMAR1 Q99720 1/20 0.34
TAAR1 Q96RJ0 2/20 0.33
LPL P06858 1/20 0.33
LIPG Q9Y5X9 1/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA9 Q16790 2/20 0.33
KCNH2 Q12809 1/20 0.33
CNR2 P34972 2/20 0.32
CNR1 P21554 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
SCHEMBL866909 0.85 TP53 (0.44) KDM4ENPC1ALDH1A1MAPTRAB9A
SCHEMBL1982658 0.78 TSHR (0.50) ALDH1A1MAPTHPGDSMN1; SMN2HSD17B10
SCHEMBL5656746 0.77 TSHR (0.44) ALDH1A1RAB9ATAAR1
SCHEMBL27351758 0.77 TAAR1 (0.54) TAAR1
SCHEMBL1775203 0.77 TSHR (0.44) RAB9ASMN1; SMN2TAAR1
SCHEMBL1368894 0.74 LPL (0.37) HSD11B1KDM4ENPC1ALDH1A1MAPT
SCHEMBL16143237 0.74 TAAR1 (0.38) ALDH1A1MAPTHPGDTAAR1CNR2
SCHEMBL1951510 0.73 FFAR1 (0.54) HSD11B1KDM4ENPC1ALDH1A1MAPT
SCHEMBL1370523 0.73 CNR1 (0.35) HSD11B1KDM4ENPC1ALDH1A1MAPT
SCHEMBL5783938 0.73 CYP3A4 (0.35) KDM4EALDH1A1MAPTHPGDSMN1; SMN2

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-109311844-B Triazine compound, method for producing same, and organic electroluminescent element containing same as constituent component 东曹株式会社 2021-07-20 CN disclosed
US-20080207864-A1 Organosilanes, Process For Production of the Same, and Use Thereof SHARP KABUSHIKI KAISHA (JP) 2008-08-28 US disclosed