SCHEMBL11265656

SCHEMBL11265656

CCCCC(O)(c1ccccc1)c1ccc2nc(N)n(C3=NCCS3)c2c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACSS2 Q9NR19 5/20 0.35
RORC P51449 2/20 0.35
SIGMAR1 Q99720 2/20 0.34
TLR8 Q9NR97 4/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CHRM4 P08173 4/20 0.32
CHRM5 P08912 4/20 0.32
CHRM3 P20309 4/20 0.32
CHRM2 P08172 3/20 0.32
CHRM1 P11229 3/20 0.32
BCL2 P10415 1/20 0.32
KDM4E B2RXH2 1/20 0.31
HTR1A P08908 1/20 0.31
CYP2D6 P10635 1/20 0.31
DRD2 P14416 1/20 0.31
DRD1 P21728 1/20 0.31
HTR2A P28223 1/20 0.31
OPRM1 P35372 1/20 0.31
DRD3 P35462 1/20 0.31

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
SCHEMBL11263802 0.91 ACSS2 (0.37) ACSS2
SCHEMBL11157729 0.84 ACSS2 (0.34) ACSS2MEN1KMT2A
SCHEMBL11266932 0.81 ACSS2 (0.37) ACSS2
SCHEMBL11296476 0.76 TLR8 (0.35) ACSS2TLR8MEN1KMT2AKDM4E
SCHEMBL11147995 0.74 ACSS2 (0.32) ACSS2
SCHEMBL11269832 0.73 PI4KB (0.32) ACSS2SIGMAR1
SCHEMBL11263874 0.71 PI4KB (0.35) MEN1KMT2AKDM4E
SCHEMBL11260958 0.71 PI4KB (0.35) ACSS2MEN1KMT2AKDM4E
SCHEMBL8518156 0.71 NOS2 (0.45) TLR8MEN1KMT2ACYP2D6
SCHEMBL11557174 0.69 PI4KB (0.51) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4338315-A RHINOVIRUSES ELI LILLY AND COMPANY (US) 1982-07-06 US disclosed
US-4293558-A Antiviral thiazolinyl benzimidazoles and derivatives ELI LILLY AND COMPANY (US) 1981-10-06 US disclosed
US-4216313-A Antiviral thiazinyl benzimidazoles ELI LILLY AND COMPANY (US) 1980-08-05 US disclosed
US-4150028-A Antiviral thiazolinyl benzimidazoles ELI LILLY AND COMPANY (US) 1979-04-17 US disclosed