SCHEMBL11539596

SCHEMBL11539596

[O-][S+](c1ccccn1)c1ccccc1O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.34
HPGD P15428 2/20 0.34
L3MBTL1 Q9Y468 5/20 0.33
METAP1 P53582 2/20 0.33
TSHR P16473 2/20 0.33
HDAC8 Q9BY41 2/20 0.33
MMP2 P08253 1/20 0.33
CHRM1 P11229 1/20 0.33
COMT P21964 1/20 0.33
ADRA1A P35348 1/20 0.33
METAP2 P50579 1/20 0.33
HSP90AA1 P07900 1/20 0.33
KDM4E B2RXH2 5/20 0.32
LMNA P02545 4/20 0.32
POLB P06746 2/20 0.32
BLM P54132 2/20 0.32
HIF1A Q16665 2/20 0.32
P4HTM Q9NXG6 2/20 0.32
CYP1A2 P05177 1/20 0.32
CCR1 P32246 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
SCHEMBL1573687 0.80 KDM4E (0.43) ALDH1A1HPGDL3MBTL1METAP1HDAC8
SCHEMBL18337 0.77 ALDH1A1 (0.47) ALDH1A1HPGDL3MBTL1TSHRMMP2
SCHEMBL29646229 0.77 ALDH1A1 (0.47) ALDH1A1HPGDL3MBTL1TSHRMMP2
SCHEMBL11322501 0.75 ALDH1A1 (0.45) ALDH1A1HPGDL3MBTL1TSHRMMP2
SCHEMBL5034185 0.72 KDM4E (0.38) ALDH1A1HPGDL3MBTL1METAP1HDAC8
SCHEMBL9563677 0.70 ALDH1A1 (0.39) ALDH1A1HPGDL3MBTL1TSHRMMP2
SCHEMBL3254805 0.67
SCHEMBL6970710 0.67
SCHEMBL20048805 0.67
SCHEMBL2759539 0.67

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
US-4132784-A (Substituted pyridyl)phenoxy phosphorus compounds and their use as insecticides THE DOW CHEMICAL COMPANY (US) 1979-01-02 US disclosed
US-4132783-A (Substituted pyridyl)phenoxy phosphorus compounds and their use as insecticides THE DOW CHEMICAL COMPANY (US) 1979-01-02 US disclosed
US-4080443-A (Substituted pyridyl)phenoxy phosphorous compounds and their use as insecticides THE DOW CHEMICAL COMPANY (US) 1978-03-21 US disclosed