SCHEMBL10868280

SCHEMBL10868280

C#Cc1ccc(-c2cc(C#Cc3ccccc3)ccc2Oc2ccc(C#Cc3ccccc3)cc2-c2ccc(C#C)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 6/20 0.41
FFAR1 O14842 1/20 0.38
APP P05067 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.37
MAPT P10636 1/20 0.35
HNF4A P41235 1/20 0.34
HAO1 Q9UJM8 1/20 0.34
ASIC3 Q9UHC3 1/20 0.33
CYP1A1 P04798 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP1B1 Q16678 1/20 0.33
AAK1 Q2M2I8 1/20 0.33
PDGFRB P09619 1/20 0.33
PDGFRA P16234 1/20 0.33

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
SCHEMBL7038780 0.78 NCOA1 (0.42)
SCHEMBL5872097 0.78 APP (0.48) GRM5FFAR1APPMAPTCYP1A1
SCHEMBL7035101 0.76 PELI1 (0.36) CYP1A2CYP1B1
SCHEMBL28431396 0.75 APP (0.67) GRM5FFAR1APPMAPTCYP1A2
SCHEMBL709245 0.75 APP (0.67) GRM5FFAR1APPMAPTCYP1A2
SCHEMBL7526751 0.74 GRM5 (0.56) GRM5APPMAPTHNF4AASIC3
SCHEMBL15772642 0.73 APP (0.63) GRM5FFAR1APPMAPTCYP1A2
Diphenylacetylene SCHEMBL20893441 0.73 APP (0.71) GRM5FFAR1APPMAPTCYP1A2
SCHEMBL12760764 0.72 FFAR1 (0.42) GRM5FFAR1APPMAPTCYP1A1
SCHEMBL7997661 0.72 GRM5 (0.55) GRM5APPMAPTHNF4AASIC3

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
EP-0179365-A2 Process for filling deep dielectric isolation trenches in semiconductor devices International Business Machines Corporation (US) 1986-04-30 EP disclosed