SCHEMBL5647064

SCHEMBL5647064

COC(=O)c1cc2c3c(ccc2cc1N1CCOCC1)OC(c1ccccc1)(c1ccccc1)C=C3

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.42
MAPK1 P28482 5/20 0.42
ALOX15 P16050 4/20 0.42
MAPT P10636 7/20 0.40
ALDH1A1 P00352 5/20 0.39
PRKDC P78527 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.38
KDM4E B2RXH2 3/20 0.38
PIK3CA P42336 1/20 0.37
PIK3CB P42338 1/20 0.37
CNR1 P21554 1/20 0.37
TSHR P16473 1/20 0.37
ATM Q13315 1/20 0.37
NPSR1 Q6W5P4 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
SCHEMBL13061587 0.77 ALOX5 (0.43) GAAMAPTALDH1A1MEN1KMT2A
SCHEMBL361912 0.77 LCK (0.45) GAAALOX15MAPTALDH1A1KDM4E
SCHEMBL5551024 0.75 KMT2A (0.42) MAPK1MAPTALDH1A1MEN1KMT2A
SCHEMBL5650444 0.74 MAPT (0.38) MAPK1ALOX15MAPTALDH1A1PRKDC
SCHEMBL10026219 0.74 TSHR (0.36) GAAMAPK1MAPTALDH1A1MEN1
SCHEMBL4784200 0.73 NCF1 (0.42) GAAMAPTALDH1A1PRKDCHSD17B10
SCHEMBL1387201 0.73 POLB (0.40) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL4670962 0.72 PRKDC (0.39) GAAMAPK1MAPTALDH1A1PRKDC
SCHEMBL7479031 0.72 SMN1; SMN2 (0.43) GAAMAPK1MAPTALDH1A1PRKDC
SCHEMBL1334076 0.72 MAPT (0.48) GAAMAPK1MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7166357-B2 Photochromic articles that activate behind ultraviolet radiation blocking transparencies and methods for preparation TRANSITIONS OPTICAL, INC. (US) 2007-01-23 US claimed
US-20040185268-A1 Photochromic articles that activate behind ultraviolet radiation blocking transparencies and methods for preparation TRANSITIONS OPTICAL LIMITED (IE) 2004-09-23 US claimed
US-7166357-B2 Photochromic articles that activate behind ultraviolet radiation blocking transparencies and methods for preparation TRANSITIONS OPTICAL, INC. (US) 2007-01-23 US disclosed
US-20040185268-A1 Photochromic articles that activate behind ultraviolet radiation blocking transparencies and methods for preparation TRANSITIONS OPTICAL LIMITED (IE) 2004-09-23 US disclosed