SCHEMBL9151069

SCHEMBL9151069

CCCC[N+](CCCC)(CCCC)Cc1ccccc1.Nc1ccc(S(=O)(=O)[O-])c2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 4/20 0.39
NR4A1 P22736 1/20 0.38
DNM1 Q05193 2/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPK1 P28482 2/20 0.35
TP53 P04637 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CYP1A2 P05177 1/20 0.35
HTT P42858 2/20 0.35
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32
THRB P10828 1/20 0.32
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
ALOX12 P18054 1/20 0.32
RECQL P46063 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TTR P02766 1/20 0.32

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
SCHEMBL9503533 0.98 NSD2 (0.38) NSD2NR4A1DNM1MEN1KMT2A
SCHEMBL9877769 0.86 TTR (0.45) NSD2DNM1MEN1KMT2AMAPK1
SCHEMBL14927 0.86 LDHA (0.41) NR4A1DNM1MEN1KMT2AMAPK1
Hydrochloric Acid SCHEMBL28523486 0.85 LDHA (0.40) NR4A1DNM1MEN1KMT2AMAPK1
SCHEMBL10383985 0.82 NSD2 (0.44) NSD2NR4A1DNM1MAPK1ALDH1A1
SCHEMBL16412126 0.81 DNM1 (0.43) DNM1MEN1KMT2AMAPK1TP53
SCHEMBL10383940 0.81 NR4A1 (0.46) NR4A1DNM1MEN1KMT2AMAPK1
Sulfuric Acid SCHEMBL2908891 0.80 DNM1 (0.49) DNM1MEN1KMT2AMAPK1TP53
SCHEMBL8959248 0.79 KCNH2 (0.44) MEN1KMT2AMAPK1TP53SMN1; SMN2
SCHEMBL16412124 0.79 LDHA (0.44) NR4A1MEN1KMT2ATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4931588-A SUBSTITUTED QUATERNARY AMMONIUM NAPHTHALENE SULFONATES ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 1990-06-05 US claimed
US-4826749-A QUATERNARY AMMONIUM SALT ORIENT CHEMICAL INDUSTRIES LTD. (JP) 1989-05-02 US claimed
US-5427884-A Toner is a quaternary ammonium salt and,or a organonitrogen polymer MINOLTA CAMERA KABUSHIKI KAISHA (JP) 1995-06-27 US disclosed
EP-0242420-B1 A TONER FOR DEVELOPING ELECTROSTATIC LATENT IMAGES AND A USE THEREOF ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 1990-12-05 EP disclosed
US-4931588-A SUBSTITUTED QUATERNARY AMMONIUM NAPHTHALENE SULFONATES ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 1990-06-05 US disclosed
US-4826749-A QUATERNARY AMMONIUM SALT ORIENT CHEMICAL INDUSTRIES LTD. (JP) 1989-05-02 US disclosed
EP-0242420-A1 A toner for developing electrostatic latent images and a use thereof ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 1987-10-28 EP disclosed