SCHEMBL6846716

SCHEMBL6846716

COc1cc(Nc2ccccc2)ccc1[N+]#N.Cc1cc(C)c(S(=O)(=O)[O-])c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.40
KMT2A Q03164 7/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
LMNA P02545 2/20 0.40
TSHR P16473 1/20 0.40
HTT P42858 1/20 0.40
KEAP1 Q14145 4/20 0.39
PPARG P37231 1/20 0.38
PPARD Q03181 1/20 0.38
PPARA Q07869 1/20 0.38
P2RY4 P51582 2/20 0.38
ALDH1A1 P00352 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
GAA P10253 1/20 0.36
RAPGEF4 Q8WZA2 1/20 0.36
CASP3 P42574 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
ALOX12 P18054 1/20 0.36

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
Sulfuric Acid SCHEMBL1123017 0.87 PPARG (0.44) MEN1KMT2ASMN1; SMN2LMNAHTT
SCHEMBL5676591 0.87 KMT2A (0.46) MEN1KMT2ASMN1; SMN2LMNAHTT
Sulfuric Acid SCHEMBL6929881 0.86 PPARG (0.43) MEN1KMT2ASMN1; SMN2LMNAHTT
Sulfuric Acid SCHEMBL5698877 0.85 MEN1 (0.45) MEN1KMT2ALMNAHTTPPARG
Sulfuric Acid SCHEMBL6357625 0.82 MEN1 (0.47) MEN1KMT2ALMNAPPARGPPARD
SCHEMBL92096 0.82 MEN1 (0.47) MEN1KMT2ATSHRPPARGPPARD
SCHEMBL1764456 0.82 PPARG (0.43) MEN1KMT2ALMNATSHRHTT
Trifluoromethanesulfonic Acid SCHEMBL11060685 0.82 PPARG (0.41) MEN1KMT2ALMNAHTTPPARG
Hydrochloric Acid SCHEMBL8080600 0.81 MEN1 (0.46) MEN1KMT2ATSHRPPARGPPARD
Bromide SCHEMBL9172630 0.81 MEN1 (0.46) MEN1KMT2ATSHRPPARGPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4248959-A Preparation of diazo printing plates using laser exposure AMERICAN HOECHST CORPORATION (US) 1981-02-03 US claimed
US-6699638-B2 ON A THERMAL CROSSLINKING LAYER A WATER SOLUBLE OVERCOAT LAYER, AND AT LEAST ONE OF THESE LAYERS CONTAINS A COMPOUND CAPABLE OF CONVERTING LIGHT INTO HEAT; EASY TO HANDLE AND CAUSES NO DEFECTS EVEN WHEN TOUCHED WITH FINGERS FUJI PHOTO FILM CO., LTD. (JP) 2004-03-02 US disclosed
US-20010031423-A1 On a thermal crosslinking layer a water soluble overcoat layer, and at least one of these layers contains a compound capable of converting light into heat; easy to handle and causes no defects even when touched with fingers FUJIFILM CORPORATION (JP) 2001-10-18 US disclosed
US-4486529-A WAVELENGTH GREATER THAN 450 NANOMETERS AMERICAN HOECHST CORPORATION (US) 1984-12-04 US disclosed
US-4248959-A Preparation of diazo printing plates using laser exposure AMERICAN HOECHST CORPORATION (US) 1981-02-03 US disclosed