SCHEMBL8913253

SCHEMBL8913253

C=CCc1ccc(C(=O)Oc2ccc(CCCC)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 10/20 0.58
THRA P10827 6/20 0.55
MAPT P10636 4/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
KMT2A Q03164 3/20 0.49
MEN1 O00255 2/20 0.49
RARB P10826 1/20 0.46
PLK1 P53350 1/20 0.46
CYP3A4 P08684 2/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PRSS1 P07477 1/20 0.45
ACR P10323 1/20 0.45
NPC1 O15118 2/20 0.45
LMNA P02545 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
NFKB1 P19838 1/20 0.44

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
SCHEMBL8913388 0.92 THRB (0.61) THRBTHRAMAPTSMN1; SMN2KMT2A
SCHEMBL8923657 0.89 THRB (0.58) THRBTHRAMAPTSMN1; SMN2KMT2A
SCHEMBL8912760 0.89 THRB (0.58) THRBTHRAMAPTSMN1; SMN2KMT2A
SCHEMBL8914596 0.89 LMNA (0.58) THRBMAPTSMN1; SMN2KMT2ACYP3A4
SCHEMBL5665942 0.89 THRB (0.58) THRBTHRAMAPTSMN1; SMN2KMT2A
SCHEMBL7951967 0.89 THRB (0.58) THRBTHRAMAPTSMN1; SMN2KMT2A
SCHEMBL7210214 0.89 THRB (0.58) THRBTHRAMAPTSMN1; SMN2KMT2A
SCHEMBL778221 0.89 THRB (0.58) THRBTHRAMAPTSMN1; SMN2KMT2A
SCHEMBL8911968 0.88 THRB (0.60) THRBTHRAMAPTSMN1; SMN2KMT2A
SCHEMBL3618792 0.88 THRB (0.76) THRBTHRAMAPTSMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE35462-E Silylated benzoic acid derivatives CONSORTIUM FUR ELEKOCHEMISCHE IND. GMBH (DE) 1997-02-25 US disclosed
US-5277838-A Silylated benzoic acid derivatives CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 1994-01-11 US disclosed
US-5106530-A Liquid crystals Consortium Fur Elektrochemische Ind. (DE) 1992-04-21 US disclosed