SCHEMBL7766523

SCHEMBL7766523

Nc1ccc(Oc2ccc(N)c(S(N)(=O)=O)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.50
MAPT P10636 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
TDP1 Q9NUW8 3/20 0.50
TSHR P16473 2/20 0.50
MEN1 O00255 1/20 0.50
MITF O75030 1/20 0.50
GAA P10253 1/20 0.50
GFER P55789 1/20 0.50
KMT2A Q03164 1/20 0.50
NLRP1 Q9C000 1/20 0.50
NOD2 Q9HC29 1/20 0.50
CYP3A4 P08684 1/20 0.50
HTT P42858 1/20 0.47
NR4A1 P22736 1/20 0.45
MAOA P21397 2/20 0.44
SOS1 Q07889 2/20 0.44
MAPK1 P28482 2/20 0.43
NPC1 O15118 1/20 0.43
HPGD P15428 1/20 0.43

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
SCHEMBL3776725 0.88 SOS1 (0.58) ALDH1A1MAPTSMN1; SMN2TSHRMEN1
SCHEMBL7761842 0.86 ALDH1A1 (0.50) ALDH1A1MAPTSMN1; SMN2TDP1TSHR
SCHEMBL7765529 0.85 MAOB (0.53) ALDH1A1MAPTSMN1; SMN2MEN1MITF
SCHEMBL11311935 0.84 ALDH1A1 (0.48) ALDH1A1MAPTSMN1; SMN2TDP1TSHR
Ammonia Solution, Strong SCHEMBL7554725 0.83 ALDH1A1 (0.47) ALDH1A1MAPTSMN1; SMN2TDP1TSHR
SCHEMBL3482658 0.80 SOS1 (0.40) ALDH1A1MAPTHTTNR4A1SOS1
Trimethylammonium SCHEMBL7551112 0.79 CTDSP1 (0.46) ALDH1A1MAPTSMN1; SMN2TDP1TSHR
SCHEMBL31095544 0.78 CA2 (0.54) ALDH1A1MAPTTDP1TSHRMEN1
SCHEMBL393315 0.78 CA2 (0.54) ALDH1A1MAPTTDP1TSHRMEN1
SCHEMBL1523775 0.78 CA2 (0.50) ALDH1A1MAPTSMN1; SMN2TDP1MEN1

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-0758665-B1 Polyimides and optical parts obtained by using the same HITACHI CHEMICAL CO LTD (JP) 2001-06-20 EP disclosed
US-5837804-A MULTILAYER POLYIMIDES FOR TRANSPARENCY AND OPTICAL WAVEGUIDES HITACHI CHEMICAL COMPANY, LTD. (JP) 1998-11-17 US disclosed
EP-0758665-A1 Polyimides and optical parts obtained by using the same HITACHI CHEMICAL COMPANY, LTD. (JP) 1997-02-19 EP disclosed