SCHEMBL13703248

SCHEMBL13703248

Cc1ccc(Oc2ccc([SH](=O)=O)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TEAD4 Q15561 1/20 0.52
ALDH1A1 P00352 3/20 0.50
TDP1 Q9NUW8 2/20 0.50
POLB P06746 1/20 0.50
MAPT P10636 1/20 0.50
HTT P42858 3/20 0.46
MMP13 P45452 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ACHE P22303 1/20 0.42
FFAR1 O14842 1/20 0.42
TSHR P16473 2/20 0.41
CYP3A4 P08684 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
LMNA P02545 2/20 0.40
PNLIP P16233 1/20 0.40
GAA P10253 2/20 0.39
NPC1 O15118 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL13703251 0.94 TEAD4 (0.47) TEAD4ALDH1A1TDP1POLBMAPT
SCHEMBL13788529 0.88 ALDH1A1 (0.41) ALDH1A1TDP1MAPTHTTSMN1; SMN2
SCHEMBL13743035 0.85 ACHE (0.50) ALDH1A1TDP1POLBMAPTSMN1; SMN2
SCHEMBL18312015 0.83 HTT (0.61) TEAD4ALDH1A1TDP1MAPTHTT
Water SCHEMBL25409091 0.83 ACHE (0.47) ALDH1A1TDP1POLBMAPTSMN1; SMN2
SCHEMBL27756606 0.83 ACHE (0.47) ALDH1A1TDP1POLBMAPTSMN1; SMN2
SCHEMBL29152107 0.83 ACHE (0.47) ALDH1A1TDP1POLBMAPTSMN1; SMN2
SCHEMBL27564735 0.83 ACHE (0.47) ALDH1A1TDP1POLBMAPTSMN1; SMN2
SCHEMBL27836143 0.83 ACHE (0.47) ALDH1A1TDP1POLBMAPTSMN1; SMN2
SCHEMBL28724358 0.83 ACHE (0.47) ALDH1A1TDP1POLBMAPTSMN1; SMN2

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-2033985-B1 Heat-curable polyimide silicone resin composition SHINETSU CHEMICAL CO (JP) 2017-04-12 EP disclosed
US-20090233142-A2 POLYMER HAVING OXOCARBON GROUP, AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-09-17 US disclosed