SCHEMBL9479593

SCHEMBL9479593

O=S(=O)(Nc1ccc(Nc2ccc(Nc3ccccc3)cc2)cc1)c1ccc2ccccc2c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.73
ATM Q13315 1/20 0.72
SMN1; SMN2 Q16637 3/20 0.71
LMNA P02545 2/20 0.71
ALDH1A1 P00352 5/20 0.65
GAA P10253 2/20 0.65
PKM P14618 2/20 0.64
PKLR P30613 1/20 0.64
KMT2A Q03164 7/20 0.62
MEN1 O00255 6/20 0.62
CYP3A4 P08684 1/20 0.62
HPGD P15428 1/20 0.62
HSD17B10 Q99714 1/20 0.62
SNCA P37840 1/20 0.62
GPR27 Q9NS67 1/20 0.60
AKR1C3 P42330 1/20 0.59
MAPT P10636 2/20 0.59
PLAU P00749 3/20 0.58
HDAC1 Q13547 1/20 0.58
HTT P42858 1/20 0.57

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
SCHEMBL20021987 0.93 PGR (0.77) PGRATMSMN1; SMN2LMNAALDH1A1
SCHEMBL29549847 0.93 PGR (0.77) PGRATMSMN1; SMN2LMNAALDH1A1
SCHEMBL28396503 0.93 PGR (0.77) PGRATMSMN1; SMN2LMNAALDH1A1
SCHEMBL9479802 0.92 SMN1; SMN2 (0.69) PGRATMSMN1; SMN2LMNAALDH1A1
SCHEMBL9942088 0.84 ATM (0.72) PGRATMSMN1; SMN2LMNAALDH1A1
SCHEMBL20021984 0.84 ATM (0.72) PGRATMSMN1; SMN2LMNAALDH1A1
SCHEMBL808105 0.84 ATM (0.72) PGRATMSMN1; SMN2LMNAALDH1A1
SCHEMBL7782154 0.83 ALDH1A1 (0.77) PGRATMSMN1; SMN2LMNAALDH1A1
SCHEMBL2614387 0.83 SMN1; SMN2 (1.00) PGRATMSMN1; SMN2LMNAALDH1A1
SCHEMBL8752432 0.81 PLAU (0.76) PGRATMSMN1; SMN2LMNAALDH1A1

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-5210065-A A mixture of an aromatic amine, an oxidizer and an acid MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1993-05-11 US disclosed
EP-0479578-A1 Color-forming recording material MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1992-04-08 EP disclosed