SCHEMBL5478247

SCHEMBL5478247

Clc1ccc(Nc2nc(-c3ccc(N4CCCCC4)cc3)cn3ccnc23)cc1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 2/20 0.61
▸ SYK P43405 18/20 0.58
▸ CD63 P08962 2/20 0.58
▸ JAK2 O60674 1/20 0.57
▸ NTRK1 P04629 1/20 0.57
▸ ROS1 P08922 1/20 0.57
▸ CSNK2A2 P19784 1/20 0.57
▸ FLT3 P36888 1/20 0.57
▸ CSNK2B P67870 1/20 0.57
▸ CSNK2A1 P68400 1/20 0.57
▸ BTK Q06187 1/20 0.57
▸ PTK6 Q13882 1/20 0.57
▸ CSNK2A3 Q8NEV1 1/20 0.57

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
SCHEMBL2482275 0.85 AURKA (0.79) AURKASYKCD63JAK2NTRK1
SCHEMBL5479137 0.83 AURKA (0.59) AURKASYKBTK
SCHEMBL27306130 0.81 SYK (0.60) AURKASYKCD63JAK2NTRK1
SCHEMBL3422119 0.81 SYK (0.86) SYKJAK2NTRK1ROS1CSNK2A2
SCHEMBL19998666 0.80 AURKA (0.53) AURKASYKCD63JAK2NTRK1
SCHEMBL23911850 0.80 AURKA (0.81) AURKASYKCD63JAK2NTRK1
SCHEMBL2480971 0.80 SYK (0.87) SYKJAK2NTRK1ROS1CSNK2A2
SCHEMBL6517337 0.78 AURKA (0.55) AURKASYKCD63JAK2NTRK1
SCHEMBL5478244 0.77 AURKA (0.56) AURKASYKCD63JAK2NTRK1
SCHEMBL2481450 0.77 AURKA (0.69) AURKASYKCD63JAK2NTRK1

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
US-7312341-B2 6-aryl-imidazo[1,2-a] pyrazin-8-ylamines, method of making, and method of use thereof CGI PHARMACEUTICALS, INC. (US) 2007-12-25 — — US claimed
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