SCHEMBL16229402

SCHEMBL16229402

Cc1ccccc1-c1c[nH]c(N)c1C#N

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
LRRK2 Q5S007 1/20 0.43
TSHR P16473 1/20 0.37
KDM4E B2RXH2 6/20 0.36
ALDH1A1 P00352 5/20 0.36
HPGD P15428 3/20 0.36
HSD17B10 Q99714 3/20 0.36
STK4 Q13043 1/20 0.35
STK3 Q13188 1/20 0.35
NPC1 O15118 1/20 0.34
CASP3 P42574 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
GRM6 O15303 1/20 0.34
AR P10275 1/20 0.34
KDM5A P29375 1/20 0.34
CYP1A2 P05177 1/20 0.33

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
SCHEMBL6236169 0.77 ADORA1 (0.47) LMNALRRK2TSHRKDM4EALDH1A1
SCHEMBL1905542 0.75 ADORA1 (0.46) LRRK2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL11020788 0.74 LRRK2 (0.42) LMNALRRK2TSHRKDM4EALDH1A1
SCHEMBL3022981 0.74
SCHEMBL29993462 0.74 LMNA (0.51) LMNALRRK2TSHRKDM4EALDH1A1
SCHEMBL1539836 0.69 MAPT (0.64) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL2618362 0.69 MEN1 (0.44) ALDH1A1HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL5482017 0.69 LMNA (0.50) LMNALRRK2TSHRKDM4EALDH1A1
SCHEMBL18406710 0.68 TSHR (0.57) LMNALRRK2TSHRNPC1CASP3
SCHEMBL15214839 0.68 NPSR1 (0.33) LRRK2KDM4EALDH1A1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8883050-B2 Curable colored compositions, color filters and processes for preparing them, liquid crystal display devices, solid-state image sensors, and dye compounds FUJIFILM CORPORATION (JP) 2014-11-11 US disclosed
US-8883050-B2 Curable colored compositions, color filters and processes for preparing them, liquid crystal display devices, solid-state image sensors, and dye compounds FUJIFILM CORPORATION (JP) 2014-11-11 US disclosed