SCHEMBL30299269

SCHEMBL30299269

NC1=NC(N)(c2ccc(CN3CCN(C4CCCC4)CC3)cc2)NN1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 1/20 0.45
TSHR P16473 2/20 0.41
L3MBTL3 Q96JM7 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
TP53 P04637 1/20 0.38
HRH3 Q9Y5N1 3/20 0.38
TRPV6 Q9H1D0 2/20 0.37
HTR1D P28221 1/20 0.36

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
SCHEMBL30299294 0.91 L3MBTL3 (0.47) MEN1KMT2AALDH1A1KDM4ETSHR
SCHEMBL30299374 0.84 SMN1; SMN2 (0.35) MEN1KMT2AKDM4E
SCHEMBL30299315 0.82 LMNA (0.52) ALDH1A1KDM4ETP53HRH3
SCHEMBL30299339 0.79 HRH3 (0.39) ALDH1A1KDM4EHRH3
SCHEMBL29928437 0.78 L3MBTL3 (0.54) ALDH1A1KDM4EL3MBTL3L3MBTL1HRH3
SCHEMBL30299283 0.75 L3MBTL3 (0.54) L3MBTL3L3MBTL1
SCHEMBL30299369 0.75 AXL (0.37) KMT2AALDH1A1KDM4EHRH3
SCHEMBL30299348 0.75 GPR4 (0.42) KMT2AALDH1A1KDM4ETSHRHRH3
SCHEMBL30090685 0.75 SLC18A3 (0.39)
SCHEMBL30090687 0.74 AXL (0.38) KMT2AALDH1A1KDM4E

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-116075303-A Method of selecting patients treated with a combination of an AXL inhibitor and an immune checkpoint modulator 卑尔根生物股份公司 2023-05-05 CN disclosed
CN-115916344-A AXL inhibitors for antiviral therapy 卑尔根生物股份公司 2023-04-04 CN disclosed