SCHEMBL325272

SCHEMBL325272

Cc1ccc(Oc2ccc(C(CF)(CF)c3ccc(Oc4ccc(C)cc4)cc3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TEAD4 Q15561 1/20 0.47
MAPT P10636 4/20 0.45
ALDH1A1 P00352 3/20 0.45
POLB P06746 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
HTR2A P28223 2/20 0.42
SLC6A4 P31645 2/20 0.42
KCNH2 Q12809 1/20 0.42
MMP13 P45452 4/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
AR P10275 1/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
MAPK1 P28482 2/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
ACHE P22303 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
HTT P42858 2/20 0.38

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
SCHEMBL12318016 0.87 TSHR (0.48) MAPTALDH1A1TDP1KMT2ANPC1
SCHEMBL13427342 0.82 KMT2A (0.44) MAPTALDH1A1POLBTDP1HTR2A
SCHEMBL14217621 0.80 ALDH1A1 (0.57) TEAD4MAPTALDH1A1POLBTDP1
SCHEMBL16607384 0.79 TEAD4 (0.42) TEAD4MAPTALDH1A1POLBTDP1
SCHEMBL13907663 0.79 KIF11 (0.47) ALDH1A1POLBMEN1KMT2AMAPK1
SCHEMBL457746 0.77 HTR2A (0.53) TEAD4MAPTALDH1A1POLBTDP1
SCHEMBL13067533 0.77 CA1 (0.50) MAPTALDH1A1TDP1KCNH2NPC1
SCHEMBL12335538 0.76 ACHE (0.54) TEAD4MAPTALDH1A1POLBTDP1
SCHEMBL83814 0.75 TEAD4 (0.74) TEAD4MAPTALDH1A1POLBTDP1
SCHEMBL83863 0.75 TEAD4 (0.74) TEAD4MAPTALDH1A1POLBTDP1

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-8133931-B2 Acrylate nanocomposite material NATIONAL TAIWAN UNIVERSITY (TW) 2012-03-13 US disclosed
US-20100113638-A1 Acrylate Nanocomposite Material NATIONAL TAIWAN UNIVERSITY (TW) 2010-05-06 US disclosed