SCHEMBL8153382

SCHEMBL8153382

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

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ DPEP1 P16444 1/20 0.40
▸ TDP1 Q9NUW8 2/20 0.38
▸ POLB P06746 1/20 0.38
▸ APEX1 P27695 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ ALOX5 P09917 2/20 0.35
▸ PTGES O14684 1/20 0.35
▸ PPARG P37231 1/20 0.35
▸ TSHR P16473 2/20 0.35
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ MAOA P21397 4/20 0.33
▸ MAOB P27338 4/20 0.33
▸ DNM1 Q05193 2/20 0.32
▸ PTP4A3 O75365 1/20 0.32
▸ PTP4A1 Q93096 1/20 0.32
▸ IDO1 P14902 1/20 0.32
▸ VCP P55072 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
SCHEMBL8151214 0.93 DPEP1 (0.41) DPEP1TDP1POLBAPEX1HTT
SCHEMBL8157455 0.90 APEX1 (0.40) TDP1POLBAPEX1HTTALOX5
SCHEMBL8158710 0.87 DPEP1 (0.40) DPEP1TDP1POLBAPEX1HTT
SCHEMBL8150711 0.84 MEN1 (0.44) DPEP1TDP1POLBAPEX1HTT
SCHEMBL8152924 0.83 TRPA1 (0.38) DPEP1TDP1POLBAPEX1HTT
SCHEMBL8157301 0.82 GRIK1 (0.44) TDP1POLBAPEX1HTTALOX5
SCHEMBL8150943 0.82 POLB (0.40) TDP1POLBAPEX1HTTALOX5
SCHEMBL8152443 0.81 POLB (0.40) DPEP1TDP1POLBAPEX1HTT
SCHEMBL8151217 0.80 HTT (0.43) TDP1POLBAPEX1HTTALOX5
SCHEMBL8156645 0.80 PTGS2 (0.43) TDP1POLBAPEX1HTTALOX5

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
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