SCHEMBL11808770

SCHEMBL11808770

O=C(NN1C(=O)c2c(F)c(F)c(F)c(F)c2C1=O)c1ccccc1O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 1/20 0.68
▸ PTGS2 P35354 1/20 0.68
▸ KDM4E B2RXH2 9/20 0.49
▸ HPGD P15428 3/20 0.49
▸ HTT P42858 3/20 0.49
▸ RECQL P46063 2/20 0.49
▸ MEN1 O00255 7/20 0.49
▸ KMT2A Q03164 7/20 0.49
▸ MAPT P10636 5/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ USP2 O75604 1/20 0.49
▸ GAA P10253 4/20 0.46
▸ MPO P05164 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ MAPK1 P28482 1/20 0.45
▸ L3MBTL1 Q9Y468 3/20 0.43
▸ LMNA P02545 2/20 0.42
▸ TP53 P04637 2/20 0.42
▸ NPC1 O15118 2/20 0.42

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
SCHEMBL11806081 0.88 PTGS1 (0.68) PTGS1PTGS2KDM4EHPGDHTT
SCHEMBL11812518 0.86 PTGS1 (0.73) PTGS1PTGS2KDM4EHPGDHTT
SCHEMBL11816591 0.82 PTGS1 (0.72) PTGS1PTGS2KDM4EHPGDHTT
SCHEMBL11812121 0.82 PTGS1 (0.68) PTGS1PTGS2KDM4EHPGDHTT
SCHEMBL11803258 0.82 PTGS1 (0.68) PTGS1PTGS2KDM4EHPGDHTT
SCHEMBL11806473 0.82 PTGS1 (0.68) PTGS1PTGS2KDM4EHPGDHTT
SCHEMBL11812573 0.82 PTGS1 (0.68) PTGS1PTGS2KDM4EHPGDHTT
SCHEMBL11817658 0.82 PTGS1 (0.68) PTGS1PTGS2KDM4EHPGDHTT
SCHEMBL11806351 0.82 PTGS1 (0.68) PTGS1PTGS2KDM4EHPGDHTT
SCHEMBL577155 0.81 PTGS1 (1.00) PTGS1PTGS2KDM4EHPGDHTT

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-3956331-A STABILIZER FOR POLYOLEFIN UBE INDUSTRIES, LTD. (JA) 1976-05-11 — — US disclosed
US-3933736-A HOMO- AND CO-POLYMERS OF ETHYLENE, PROPYLENE, BUTENE-1, PENTENE-1, AND 4-METHYLPENTENE-1 WITH ETHYL ACRYLATE OR VINYL ACETATE UBE INDUSTRIES, LTD. (JA) 1976-01-20 — — US disclosed
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