SCHEMBL16918204

SCHEMBL16918204

Cc1ccc(Oc2ccc(CF)c(F)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TEAD4 Q15561 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ POLB P06746 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ AR P10275 2/20 0.40
▸ SLC6A4 P31645 7/20 0.39
▸ HTR2A P28223 6/20 0.39
▸ KCNH2 Q12809 4/20 0.39
▸ HTT P42858 2/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ LPAR1 Q92633 1/20 0.37
▸ LPAR3 Q9UBY5 1/20 0.37
▸ SOS1 Q07889 1/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ PDE4A P27815 1/20 0.36
▸ PDE4B Q07343 1/20 0.36
▸ PDE4C Q08493 1/20 0.36

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
SCHEMBL20837454 0.84 MEN1 (0.46) TEAD4ALDH1A1TDP1POLBMAPT
SCHEMBL16918059 0.83 S1PR1 (0.39) SLC6A4HTR2AKCNH2SOS1SMN1; SMN2
SCHEMBL15360093 0.81 HTR2A (0.44) TEAD4ALDH1A1TDP1POLBMAPT
SCHEMBL14670022 0.79 LTA4H (0.50) MEN1KMT2ASOS1
SCHEMBL257856 0.79 SOS1 (0.55) TEAD4ALDH1A1TDP1POLBMAPT
SCHEMBL10285184 0.78 TAAR1 (0.39) —
SCHEMBL257919 0.77 TEAD4 (0.48) TEAD4ALDH1A1TDP1POLBMAPT
SCHEMBL18354768 0.76 PTGS2 (0.36) MAPTAR
SCHEMBL15385004 0.74 SLC6A4 (0.47) TEAD4ALDH1A1TDP1POLBMAPT
SCHEMBL18210774 0.73 TEAD4 (0.48) TEAD4ALDH1A1TDP1POLBMAPT

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-9309260-B2 Inhibitors of hepatitis C virus PRESIDIO PHARMACEUTICALS, INC. (US) 2016-04-12 — — US disclosed
US-9085587-B2 Inhibitors of hepatitis C virus PRESIDIO PHARMACEUTICALS, INC. (US) 2015-07-21 — — US disclosed
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