SCHEMBL5012383

SCHEMBL5012383

c1ccc2c(c1)Cc1cc(-c3ccc4c(c3)Cc3cc(-c5ccc6cc7cc8cc9ccccc9cc8cc7cc6c5)ccc3-4)ccc1-2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.50
KDM4E B2RXH2 2/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
ALDH1A1 P00352 2/20 0.50
LMNA P02545 1/20 0.50
HPGD P15428 1/20 0.50
SRD5A2 P31213 1/20 0.45
CNR1 P21554 1/20 0.43
MMP12 P39900 1/20 0.43
MMP13 P45452 1/20 0.43
CYP3A4 P08684 2/20 0.42
CYP1A2 P05177 2/20 0.42
SLC6A2 P23975 2/20 0.42
SLC6A4 P31645 2/20 0.42
SLC6A3 Q01959 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TSHR P16473 2/20 0.41

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
SCHEMBL14092903 1.00 MAPT (0.50) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL26112223 0.89 ESR1 (0.50) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL30395577 0.87 ALDH1A1 (0.63) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL3414807 0.87 ALDH1A1 (0.63) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL1527491 0.85 MAOA (0.58) MAPTKDM4ENPC1RAB9ASMN1; SMN2
Benz(B)Anthracene SCHEMBL29144751 0.84 ALDH1A1 (0.54) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL25040097 0.83 MAPT (0.39) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL25041931 0.83 MAPT (0.39) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL28440412 0.83 ALDH1A1 (0.59) MAPTKDM4ENPC1RAB9ASMN1; SMN2
Anthracene SCHEMBL42657 0.82 ALDH1A1 (0.56) MAPTKDM4ENPC1RAB9ASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080207864-A1 Organosilanes, Process For Production of the Same, and Use Thereof SHARP KABUSHIKI KAISHA (JP) 2008-08-28 US disclosed
US-20080207864-A1 Organosilanes, Process For Production of the Same, and Use Thereof SHARP KABUSHIKI KAISHA (JP) 2008-08-28 US disclosed
US-20080207864-A1 Organosilanes, Process For Production of the Same, and Use Thereof SHARP KABUSHIKI KAISHA (JP) 2008-08-28 US disclosed