SCHEMBL8158710

SCHEMBL8158710

C=C(C)C(=O)OCCCC(=Cc1ccc(F)c(Cl)c1)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ DPEP1 P16444 1/20 0.40
▸ TRPA1 O75762 1/20 0.40
▸ POLB P06746 2/20 0.38
▸ APEX1 P27695 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ ALOX5 P09917 2/20 0.35
▸ PTGES O14684 1/20 0.35
▸ PPARG P37231 1/20 0.35
▸ TSHR P16473 3/20 0.35
▸ MAOA P21397 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ KMT2A Q03164 2/20 0.32
▸ PKM P14618 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ DNM1 Q05193 2/20 0.32
▸ GRIK1 P39086 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ MAPT P10636 1/20 0.32

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
SCHEMBL8144233 0.93 DPEP1 (0.41) DPEP1TRPA1POLBAPEX1HTT
SCHEMBL8152443 0.90 POLB (0.40) DPEP1POLBAPEX1HTTTDP1
SCHEMBL8157455 0.90 APEX1 (0.40) TRPA1POLBAPEX1HTTTDP1
SCHEMBL8153382 0.87 DPEP1 (0.40) DPEP1POLBAPEX1HTTTDP1
SCHEMBL8157301 0.86 GRIK1 (0.44) POLBAPEX1HTTTDP1ALOX5
SCHEMBL8156645 0.84 PTGS2 (0.43) POLBAPEX1HTTTDP1ALOX5
SCHEMBL8151145 0.84 APEX1 (0.40) POLBAPEX1HTTTDP1ALOX5
SCHEMBL8150711 0.84 MEN1 (0.44) DPEP1TRPA1POLBAPEX1HTT
SCHEMBL8152924 0.83 TRPA1 (0.38) DPEP1TRPA1POLBAPEX1HTT
SCHEMBL8156850 0.83 DPEP1 (0.39) DPEP1POLBAPEX1HTTTDP1

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-RE36625-E Linear and cyclic polymers or oligomers having a photoreactive ethene group ROLIC AG (CH) 2000-03-21 — — US disclosed
US-5539074-A LIQUID CRYSTAL POLYMERS ON SILICA FOR LIGHT SENSITIVE ELEMENTS HOFFMANN-LA ROCHE INC. (US) 1996-07-23 — — US disclosed
Send feedback