SCHEMBL9942514

SCHEMBL9942514

Cc1ccc(S(=O)(=O)n2cc(-c3cncc(N[C@H]4CCCN(C(=O)OC(C)(C)C)C4)c3)c3nc(-c4c(F)cccc4F)ccc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 4/20 0.39
▸ PIM2 Q9P1W9 4/20 0.39
▸ USP30 Q70CQ3 2/20 0.37
▸ BRD4 O60885 1/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ MERTK Q12866 1/20 0.35
▸ PARP1 P09874 1/20 0.35
▸ HTR6 P50406 2/20 0.35
▸ BCHE P06276 1/20 0.35
▸ RIPK2 O43353 1/20 0.34
▸ PHGDH O43175 1/20 0.34
▸ TRPV1 Q8NER1 1/20 0.34
▸ GPR119 Q8TDV5 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ HDAC4 P56524 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34

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
SCHEMBL15446264 1.00 PIM1 (0.39) PIM1PIM2USP30BRD4KMT2A
SCHEMBL9904379 1.00 PIM1 (0.39) PIM1PIM2USP30BRD4KMT2A
SCHEMBL9904239 0.80 PIM1 (0.43) PIM1PIM2USP30KMT2APARP1
SCHEMBL9904437 0.80 CKS1B (0.37) PIM1PIM2KMT2ATRPV1MEN1
SCHEMBL9904528 0.79 PIK3CD (0.39) PIM1PIM2USP30BRD4PARP1
SCHEMBL9904525 0.79 PIK3CD (0.39) PIM1PIM2USP30BRD4PARP1
SCHEMBL9904146 0.78 PIM1 (0.41) PIM1PIM2USP30BRD4PARP1
SCHEMBL9904144 0.78 PIM1 (0.41) PIM1PIM2USP30BRD4PARP1
SCHEMBL9901269 0.76 TYK2 (0.42) PIM1PIM2HTR6BCHEGPR119
SCHEMBL9901268 0.76 TYK2 (0.42) PIM1PIM2HTR6BCHEGPR119

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
WO-2012078777-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2012-06-14 — — WO disclosed
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