SCHEMBL5011002

SCHEMBL5011002

c1ccc(-c2cccc(C[C](c3cccc(-c4ccccc4)c3-c3ccccc3)c3cccc(-c4ccccc4)c3-c3ccccc3)c2-c2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 1/20 0.43
CD274 Q9NZQ7 1/20 0.43
HNF4A P41235 1/20 0.43
DPP4 P27487 1/20 0.40
KMT2A Q03164 2/20 0.39
CHRNB2 P17787 3/20 0.38
CHRNA4 P43681 3/20 0.38
BCAT2 O15382 1/20 0.38
FOLH1 Q04609 2/20 0.37
ALDH1A1 P00352 3/20 0.35
HPGD P15428 1/20 0.35
BCL2L1 Q07817 1/20 0.35
HSD17B10 Q99714 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
LMNA P02545 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL5010156 0.86 CHRNB2 (0.52) PDCD1CD274HNF4AKMT2ACHRNB2
SCHEMBL5010172 0.84 PDCD1 (0.44) PDCD1CD274HNF4ADPP4KMT2A
SCHEMBL5008840 0.84 HNF4A (0.44) PDCD1CD274HNF4AKMT2ACHRNB2
SCHEMBL3828115 0.79 PDCD1 (0.50) PDCD1CD274HNF4ADPP4KMT2A
SCHEMBL2925420 0.79 AKR1B1 (0.52) PDCD1CD274HNF4ADPP4KMT2A
SCHEMBL5008897 0.79 HNF4A (0.46) PDCD1CD274HNF4AKMT2ACHRNB2
SCHEMBL5012405 0.78 DPP4 (0.50) PDCD1CD274HNF4ADPP4KMT2A
SCHEMBL7204765 0.77 PDCD1 (0.62) PDCD1CD274HNF4ADPP4KMT2A
SCHEMBL5008902 0.76 HNF4A (0.43) PDCD1CD274HNF4AKMT2ACHRNB2
SCHEMBL28909718 0.76 FOLH1 (0.51) PDCD1CD274HNF4ADPP4KMT2A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080207864-A1 Organosilanes, Process For Production of the Same, and Use Thereof SHARP KABUSHIKI KAISHA (JP) 2008-08-28 US disclosed