SCHEMBL5773100

SCHEMBL5773100

C=CCOc1ccc(Oc2ccc(N)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
TDP1 Q9NUW8 3/20 0.56
TSHR P16473 2/20 0.56
CYP3A4 P08684 1/20 0.56
CA12 O43570 1/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA7 P43166 1/20 0.53
CA9 Q16790 1/20 0.53
MAOA P21397 2/20 0.48
MAPT P10636 5/20 0.47
TEAD4 Q15561 1/20 0.47
MAOB P27338 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.45
GAA P10253 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
POLB P06746 1/20 0.45
MITF O75030 1/20 0.45
GFER P55789 1/20 0.45

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
SCHEMBL717196 0.94 CA12 (0.58) ALDH1A1TDP1TSHRCYP3A4CA12
Hydrochloric Acid SCHEMBL9430026 0.92 CA12 (0.56) ALDH1A1TDP1TSHRCYP3A4CA12
SCHEMBL3487338 0.89 CA12 (0.57) ALDH1A1CA12CA1CA2CA7
SCHEMBL20554521 0.88 CA12 (0.53) ALDH1A1TDP1TSHRCYP3A4CA12
1,4-Diallyloxybenzene SCHEMBL302448 0.82 CA12 (0.63) ALDH1A1CA12CA1CA2CA7
SCHEMBL5973615 0.82 LTA4H (0.55) TSHRCA12CA1CA2CA7
SCHEMBL5208927 0.80 CA12 (0.49) ALDH1A1TDP1CA12CA1CA2
SCHEMBL5973047 0.80 CA12 (0.49) ALDH1A1CA12CA1CA2CA7
SCHEMBL3548978 0.80 HPGD (0.49) ALDH1A1TSHRCA12CA1CA2
SCHEMBL3416077 0.80 LTA4H (0.57) ALDH1A1CA12CA1CA2CA7

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
EP-1659148-B1 REACTIVE FLAME RETARDANT AND FLAME-RETARDANT PROCESSED RESIN OBTAINED WITH THE SAME FUJI ELECTRIC CO LTD (JP) 2013-09-18 EP disclosed
EP-1659148-A1 REACTIVE FLAME RETARDANT AND FLAME-RETARDANT PROCESSED RESIN OBTAINED WITH THE SAME FUJI ELECTRIC HOLDINGS CO., LTD. (JP) 2006-05-24 EP disclosed