SCHEMBL6847523

SCHEMBL6847523

CCCCCCCCCCCCc1ccc(S(=O)(=O)[O-])cc1.COc1ccc([N+]#N)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.46
LMNA P02545 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
TSHR P16473 1/20 0.45
CYP2C19 P33261 1/20 0.45
HTT P42858 1/20 0.45
KCNH2 Q12809 1/20 0.45
HIF1A Q16665 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.42
ALDH1A1 P00352 1/20 0.42
ALOX5 P09917 1/20 0.42
CNR2 P34972 1/20 0.42
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
FUT7 Q11130 1/20 0.41
MMP13 P45452 3/20 0.41
ALOX15B O15296 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
SCHEMBL2966037 0.84 CA2 (0.49) CA2LMNACYP2D6CYP2C9TSHR
SCHEMBL2956169 0.84 CA2 (0.49) CA2LMNACYP2D6CYP2C9TSHR
SCHEMBL9503231 0.81 CA2 (0.66) CA2LMNACYP2D6CYP2C9TSHR
SCHEMBL6849000 0.80 CA2 (0.45) CA2LMNACYP2D6CYP2C9TSHR
SCHEMBL30388893 0.80 CA2 (0.64) CA2LMNACYP2D6CYP2C9TSHR
SCHEMBL2964238 0.80 ALOX15B (0.46) CA2LMNACYP2D6CYP2C9TSHR
SCHEMBL2960491 0.80 ALOX15B (0.46) CA2LMNACYP2D6CYP2C9TSHR
SCHEMBL11149822 0.79 LMNA (0.62) CA2LMNACYP2D6CYP2C9TSHR
SCHEMBL11208696 0.79 PKM (0.61) CA2SMN1; SMN2ALDH1A1ALOX5CASP3
SCHEMBL3853262 0.78 CA2 (0.66) CA2LMNACYP2D6CYP2C9TSHR

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-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