SCHEMBL5010152

SCHEMBL5010152

C[C](CCc1cccc2ccccc12)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.49
CTNNB1 P35222 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
MTNR1A P48039 2/20 0.45
KDM4E B2RXH2 1/20 0.45
CDYL Q9Y232 1/20 0.45
CYP1A2 P05177 3/20 0.44
CYP2C19 P33261 2/20 0.44
CYP2D6 P10635 1/20 0.44
NQO2 P16083 1/20 0.44
CYP2C9 P11712 1/20 0.43
ACP3 P15309 1/20 0.42
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL5013834 0.90 SIGMAR1 (0.46) GPR84CTNNB1TDP1MTNR1ACYP1A2
SCHEMBL9800434 0.83 CYP2C19 (0.45) GPR84TDP1MTNR1AKDM4ECDYL
SCHEMBL5008796 0.82 TDP1 (0.59) CTNNB1TDP1KDM4ECYP1A2CYP2C19
SCHEMBL29137509 0.82 ACP3 (0.52) GPR84TDP1MTNR1AKDM4ECDYL
SCHEMBL11413432 0.79 GPR84 (0.49) GPR84CTNNB1TDP1MTNR1AKDM4E
SCHEMBL29580491 0.79 GPR84 (0.68) GPR84CTNNB1TDP1MTNR1AKDM4E
SCHEMBL18662750 0.79 GPR84 (0.68) GPR84CTNNB1TDP1MTNR1AKDM4E
SCHEMBL4070601 0.79 IAPP (0.56) GPR84TDP1MTNR1AKDM4ECDYL
SCHEMBL30258002 0.79 IAPP (0.56) GPR84TDP1MTNR1AKDM4ECDYL
SCHEMBL1218835 0.77 TDP1 (0.67) GPR84CTNNB1TDP1MTNR1AKDM4E

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 1 patent. 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