SCHEMBL15034679

SCHEMBL15034679

Cc1ccc(-c2ccc(C(C)C)c(-c3ccccn3)c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 2/20 0.44
▸ TP53 P04637 2/20 0.43
▸ PKM P14618 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ TGFBR1 P36897 2/20 0.43
▸ BTK Q06187 1/20 0.40
▸ DCTPP1 Q9H773 1/20 0.39
▸ KDM4E B2RXH2 4/20 0.38
▸ NPC1 O15118 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ FLT3 P36888 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ TRPA1 O75762 1/20 0.38
▸ CHRM1 P11229 1/20 0.38
▸ SLC6A2 P23975 1/20 0.38

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
SCHEMBL22448079 0.87 GRM5 (0.39) GRM5TP53PKMMEN1KMT2A
SCHEMBL18571558 0.81 BTK (0.49) GRM5TP53PKMMEN1KMT2A
SCHEMBL16410003 0.79 GRM5 (0.46) GRM5TP53PKMMEN1KMT2A
SCHEMBL19241404 0.78 KDM4E (0.44) GRM5TP53PKMMEN1KMT2A
SCHEMBL19510157 0.78 GRM5 (0.39) GRM5TP53PKMMEN1KMT2A
SCHEMBL8227726 0.76 KDM4E (0.50) TP53PKMKDM4ENPC1LMNA
SCHEMBL18088983 0.75 TGFBR1 (0.45) GRM5TP53PKMMEN1KMT2A
SCHEMBL26566524 0.75 PKM (0.51) GRM5TP53PKMMEN1KMT2A
SCHEMBL12339129 0.75 TP53 (0.57) GRM5TP53PKMMEN1KMT2A
SCHEMBL17051050 0.75 RAB9A (0.47) GRM5PKMMEN1KMT2ATGFBR1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015093814-A1 ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2015-06-25 — — WO disclosed
WO-2013122402-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2013-08-22 — — WO disclosed
WO-2013085243-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2013-06-13 — — WO disclosed
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