SCHEMBL30299385

SCHEMBL30299385

CN1CCN(C2CCN(c3ccc(C4(N)N=C(N)NN4)cn3)CC2)CC1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.37
FGFR3 P22607 1/20 0.37
ACVR1 Q04771 7/20 0.35
HRH3 Q9Y5N1 8/20 0.34
PTK2 Q05397 2/20 0.34
ALK Q9UM73 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
SCHEMBL30299262 0.89 HRH4 (0.39) HRH3
SCHEMBL30299373 0.85 HRH3 (0.37) HRH3
SCHEMBL30090686 0.80 EML4 (0.39) KCNH2FGFR3ACVR1ALK
SCHEMBL30299362 0.80 GPR4 (0.33)
SCHEMBL30090486 0.80 KCNH2 (0.39) KCNH2FGFR3ACVR1ALK
SCHEMBL30299346 0.77 RET (0.36)
SCHEMBL30299383 0.76 HRH3 (0.37) KCNH2HRH3
SCHEMBL10126760 0.76 GRIN2D (0.46) KCNH2FGFR3ACVR1HRH3
SCHEMBL30299403 0.76 MAP4K4 (0.34) HRH3
SCHEMBL30299283 0.74 L3MBTL3 (0.54)

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