SCHEMBL6716428

SCHEMBL6716428

[CH2]C(C=C)C=Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
MAOB P27338 2/20 0.44
TSHR P16473 1/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
CYP1A2 P05177 2/20 0.42
CYP3A4 P08684 1/20 0.39
TRPA1 O75762 2/20 0.39
LMNA P02545 2/20 0.38
NFE2L2 Q16236 1/20 0.38
CYP19A1 P11511 1/20 0.38
MAOA P21397 1/20 0.38
ALOX5 P09917 1/20 0.38
MAPK1 P28482 1/20 0.38
HDAC3 O15379 1/20 0.37
TNKS O95271 1/20 0.37
HDAC4 P56524 1/20 0.37
HDAC1 Q13547 1/20 0.37
HCAR2 Q8TDS4 1/20 0.37
HDAC7 Q8WUI4 1/20 0.37

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
SCHEMBL27291580 0.81 MAOB (0.44) ALDH1A1MAOBTSHRMEN1KMT2A
SCHEMBL6837422 0.79 CYP1A2 (0.48) ALDH1A1MAOBTSHRMEN1KMT2A
SCHEMBL11075392 0.76 HTR2A (0.42) ALDH1A1MAOBTSHRMEN1KMT2A
SCHEMBL13759882 0.76 ALDH1A1 (0.48) ALDH1A1MAOBTSHRMEN1KMT2A
SCHEMBL7195930 0.76 ALDH1A1 (0.42) ALDH1A1MAOBTSHRMEN1KMT2A
SCHEMBL526122 0.76 ALDH1A1 (0.48) ALDH1A1MAOBTSHRMEN1KMT2A
SCHEMBL9042298 0.76 MEN1 (0.46) ALDH1A1MAOBTSHRMEN1KMT2A
SCHEMBL7737180 0.74 CYP1A2 (0.53) ALDH1A1MAOBTSHRMEN1KMT2A
SCHEMBL3834342 0.74 CYP1A2 (0.53) ALDH1A1MAOBTSHRMEN1KMT2A
SCHEMBL5958250 0.74 CYP3A4 (0.48) ALDH1A1MAOBTSHRMEN1KMT2A

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
US-6737210-B2 CONTROLLING GLOSS; MULTICOLOR TONERS RICOH COMPANY, LTD. (JP) 2004-05-18 US disclosed
US-20030087169-A1 Image formation method, electrophotographic toners, and printed matter RICOH COMPANY, LTD. (JP) 2003-05-08 US disclosed
US-6432589-B1 SUPERIMPOSING TONER IMAGES; COLOR PHOTOGRAPHY RICOH COMPANY, LTD. (JP) 2002-08-13 US disclosed