SCHEMBL30090686

SCHEMBL30090686

Cc1cc(C2(N)N=C(N)NN2)ccc1N1CCC(N2CCN(C)CC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EML4 Q9HC35 9/20 0.39
ALK Q9UM73 9/20 0.39
RET P07949 9/20 0.39
ROS1 P08922 9/20 0.39
FLT3 P36888 9/20 0.39
FGFR3 P22607 2/20 0.37
EGFR P00533 2/20 0.36
KCNH2 Q12809 1/20 0.34
ACVR1 Q04771 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
SCHEMBL30299305 0.92 ALDH1A1 (0.38)
SCHEMBL30090486 0.89 KCNH2 (0.39) EML4ALKRETROS1FLT3
SCHEMBL30299385 0.80 KCNH2 (0.37) ALKFGFR3KCNH2ACVR1
SCHEMBL30299323 0.80 NPY2R (0.41)
SCHEMBL29929683 0.79 AXL (0.40) EGFR
SCHEMBL30299368 0.79 GAA (0.38) KCNH2
SCHEMBL29928123 0.78 AXL (0.39) EGFR
SCHEMBL30299390 0.78 PDCD1 (0.38) ALKKCNH2
SCHEMBL30299371 0.77 ALDH1A1 (0.43) FLT3
SCHEMBL30299369 0.77 AXL (0.37) ALK

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
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
CN-115414480-A Dianhydrogalactitol in combination with radiation for treatment of non-small cell lung cancer and glioblastoma multiforme 德玛医药 2022-12-02 CN disclosed