SCHEMBL7626454

SCHEMBL7626454

C=C(C)C(=O)OCCOc1cc(N=Nc2cccc(C)c2)c(O)c(C(C)(C)C)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CES2 O00748 1/20 0.36
▸ ACHE P22303 1/20 0.36
▸ CES1 P23141 1/20 0.36
▸ MAPT P10636 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ TDP1 Q9NUW8 4/20 0.34
▸ HTT P42858 2/20 0.34
▸ NPC1 O15118 2/20 0.34
▸ CASP3 P42574 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ SENP8 Q96LD8 2/20 0.34
▸ SENP7 Q9BQF6 2/20 0.34
▸ SENP6 Q9GZR1 2/20 0.34
▸ GAA P10253 1/20 0.34

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
SCHEMBL7622471 0.95 TDP1 (0.38) CES2ACHECES1MAPTSMN1; SMN2
SCHEMBL3367989 0.90 PPARA (0.42) MAPTSMN1; SMN2TDP1HTTNPC1
SCHEMBL7627025 0.90 PPARA (0.41) CES2ACHECES1MAPTSMN1; SMN2
SCHEMBL7627033 0.85 TDP1 (0.40) CES2ACHECES1MAPTSMN1; SMN2
SCHEMBL3372532 0.85 PPARA (0.44) MAPTSMN1; SMN2TDP1HTTNPC1
SCHEMBL7629752 0.85 POLB (0.45) MAPTSMN1; SMN2TDP1HTTNPC1
SCHEMBL7631080 0.85 PPARA (0.41) TDP1HTTGAAPOLBAPEX1
SCHEMBL7629965 0.83 CYP1A2 (0.40) MEN1KMT2AMAPK1TDP1HTT
SCHEMBL7626513 0.83 POLB (0.35) MAPTL3MBTL1MEN1KMT2ALMNA
SCHEMBL7627000 0.82 HTT (0.33) MAPTSMN1; SMN2MEN1KMT2AMAPK1

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
EP-1237963-A1 ARTICLES FORMED FROM PROPYLENE DIENE COPOLYMERS EXXON CHEMICAL PATENTS INC. (US) 2002-09-11 — — EP disclosed
WO-2001042323-A1 ARTICLES FORMED FROM PROPYLENE DIENE COPOLYMERS EXXON CHEMICAL PATENTS INC. (US) 2001-06-14 — — WO disclosed
US-6242551-B1 SUCH AS CONTACT LENSES, INTRAOCULAR LENSES, AND ARTIFICIAL CORNEA; REDUCES SEPARATION OR ELUTION, CHEMICALLY STABLE, AND DOES NOT DENATURE UNDER HYDROLYSIS; MAINTAINS ORIGINAL COLOR TONE MENICON CO., LTD. (JP) 2001-06-05 — — US disclosed
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