SCHEMBL16377107

SCHEMBL16377107

CCCCCCc1cc(C)c(-n2ccnc2-c2ccccc2)c(C)c1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 4/20 0.51
▸ KDR P35968 8/20 0.38
▸ CNR1 P21554 2/20 0.38
▸ CNR2 P34972 2/20 0.38
▸ TSHR P16473 1/20 0.38
▸ FLT1 P17948 3/20 0.37
▸ FLT4 P35916 3/20 0.37
▸ GPR84 Q9NQS5 1/20 0.37
▸ PDE4B Q07343 1/20 0.36
▸ RARB P10826 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
SCHEMBL10035810 0.82 HSD11B1 (0.60) HSD11B1KDRPDE4B
SCHEMBL1316463 0.81 KDR (0.52) KDRFLT1FLT4
SCHEMBL29070232 0.80 KDR (0.51) KDRFLT1FLT4
SCHEMBL29877358 0.80 KDR (0.51) KDRFLT1FLT4
SCHEMBL28848948 0.80 KDR (0.51) KDRFLT1FLT4
SCHEMBL29788366 0.80 KDR (0.51) KDRFLT1FLT4
SCHEMBL3815157 0.78 KDR (0.46) KDRFLT1FLT4
SCHEMBL16377109 0.78 LPL (0.33) HSD11B1KDR
SCHEMBL30104217 0.77 KDR (0.45) KDRFLT1FLT4
SCHEMBL30104214 0.77 KDR (0.45) KDRFLT1FLT4

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-20150001509-A1 COMPOSITION CAMBRIDGE DISPLAY TECHNOLOGY, LTD (GB) 2015-01-01 — — US disclosed
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