SCHEMBL16377108

SCHEMBL16377108

CCCCCCc1cc(C)c(N2CCN=C2c2ccccc2)c(C)c1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ S1PR1 P21453 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ KCNH2 Q12809 1/20 0.38
▸ LMNA P02545 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ CRHR1 P34998 2/20 0.37
▸ GPR84 Q9NQS5 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
SCHEMBL20960631 0.81 ALDH1A1 (0.58) ALDH1A1RECQLGAALMNA
SCHEMBL16377107 0.72 HSD11B1 (0.51) HSD11B1GPR84
SCHEMBL15755125 0.72 HSD11B1 (0.51) HSD11B1GPR84
SCHEMBL11137789 0.71 MEN1 (0.47) ALDH1A1MEN1KMT2AKCNH2NPC1
SCHEMBL11134767 0.71 MEN1 (0.47) ALDH1A1MEN1KMT2AKCNH2NPC1
SCHEMBL19027659 0.70 HSD11B1 (0.52) HSD11B1GPR84
SCHEMBL7561044 0.69 TOP2A (0.47) MEN1KMT2ANPC1
SCHEMBL29843944 0.67 PTGS2 (0.50) HSD11B1ALDH1A1MEN1KMT2AKCNH2
SCHEMBL27909193 0.67 PTGS2 (0.50) HSD11B1ALDH1A1MEN1KMT2AKCNH2
SCHEMBL9797528 0.67 RARB (0.62) HSD11B1

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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