SCHEMBL7993570

SCHEMBL7993570

OB(F)F.[O-]B(F)F.c1ccc(C[n+]2ccc(-c3ccncc3)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
KDM4E B2RXH2 2/20 0.51
RAB9A P51151 1/20 0.51
LMNA P02545 3/20 0.43
ROCK2 O75116 1/20 0.40
RPS6KA5 O75582 1/20 0.40
MAP4K4 O95819 1/20 0.40
PRKCG P05129 1/20 0.40
PRKACA P17612 1/20 0.40
RPS6KB1 P23443 1/20 0.40
MAPK1 P28482 1/20 0.40
AKT1 P31749 1/20 0.40
GSK3A P49840 1/20 0.40
GSK3B P49841 1/20 0.40
PRKX P51817 1/20 0.40
PRKCD Q05655 1/20 0.40
PRKG2 Q13237 1/20 0.40
ROCK1 Q13464 1/20 0.40
DYRK1A Q13627 1/20 0.40
PRKG1 Q13976 1/20 0.40

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
SCHEMBL1108034 0.86 ALDH1A1 (0.66) ALDH1A1KDM4ERAB9ALMNAROCK2
Hydrochloric Acid SCHEMBL7166354 0.86 ALDH1A1 (0.66) ALDH1A1KDM4ERAB9ALMNAROCK2
Benzyl Viologen SCHEMBL6665528 0.86 ALDH1A1 (0.61) ALDH1A1KDM4ERAB9ALMNACHKA
Bromide SCHEMBL10969375 0.85 ALDH1A1 (0.64) ALDH1A1KDM4ERAB9ALMNACHKA
Hydrochloric Acid SCHEMBL27637987 0.85 ALDH1A1 (0.64) ALDH1A1KDM4ERAB9ALMNAROCK2
Hydrochloric Acid SCHEMBL28357009 0.85 ALDH1A1 (0.64) ALDH1A1KDM4ERAB9ALMNAROCK2
SCHEMBL1108062 0.80 ALDH1A1 (0.62) ALDH1A1KDM4ERAB9ALMNAROCK2
SCHEMBL9999526 0.78 CHKA (0.52) ALDH1A1KDM4ERAB9ALMNACHKA
Benzyl Viologen SCHEMBL1930045 0.78 ALDH1A1 (0.78) ALDH1A1KDM4ERAB9ALMNACHKA
SCHEMBL5710992 0.76 ALDH1A1 (0.47) ALDH1A1KDM4ERAB9ALMNACHKA

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
EP-0886803-A4 IMPROVED ELECTROCHROMIC LAYER AND DEVICES COMPRISING SAME GENTEX CORP (US) 2000-04-12 EP disclosed
EP-0886803-A1 IMPROVED ELECTROCHROMIC LAYER AND DEVICES COMPRISING SAME GENTEX CORPORATION (US) 1998-12-30 EP disclosed
WO-1997034186-A1 IMPROVED ELECTROCHROMIC LAYER AND DEVICES COMPRISING SAME GENTEX CORPORATION (US) 1997-09-18 WO disclosed