SCHEMBL30299374

SCHEMBL30299374

NC1=NC(N)(c2ccc(C=CCN3CCN(C4CCCC4)CC3)cc2)NN1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.35
PKM P14618 1/20 0.35
HTT P42858 1/20 0.35
LTA4H P09960 1/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
GPR4 P46093 7/20 0.35
CTSK P43235 1/20 0.35
CHRM3 P20309 2/20 0.34
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 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
SCHEMBL30299348 0.92 GPR4 (0.42) LTA4HLMNAGPR4CTSKKMT2A
SCHEMBL30299358 0.91 GPR4 (0.43) LTA4HGPR4CTSKKMT2A
SCHEMBL30299399 0.89 GPR4 (0.37) LMNAGPR4CTSKKMT2AKDM4E
SCHEMBL30299400 0.86 LTA4H (0.47) SMN1; SMN2LTA4HLMNAGAACHRM3
SCHEMBL30299272 0.85 LTA4H (0.46) SMN1; SMN2LTA4HLMNAGAACHRM3
SCHEMBL30299269 0.84 MEN1 (0.45) KMT2AKDM4EMEN1
SCHEMBL30299386 0.83 SIGMAR1 (0.40) SMN1; SMN2LTA4HLMNAGAACHRM3
SCHEMBL30299395 0.81 TSHR (0.38) SMN1; SMN2LTA4HLMNAGAACHRM3
SCHEMBL30299376 0.81 GPR4 (0.38) LTA4HGPR4CTSK
SCHEMBL30299394 0.81 GPR4 (0.43) SMN1; SMN2PKMHTTLMNAGAA

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
CN-115916344-A AXL inhibitors for antiviral therapy 卑尔根生物股份公司 2023-04-04 CN disclosed