SCHEMBL11808596

SCHEMBL11808596

O=C(NN1C(=O)c2cc(Cl)c(Cl)cc2C1=O)c1ccccc1O

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 2/20 0.75
PTGS2 P35354 1/20 0.75
KDM4E B2RXH2 6/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
ALDH1A1 P00352 3/20 0.48
HPGD P15428 2/20 0.48
MAPT P10636 2/20 0.48
USP2 O75604 1/20 0.48
MPO P05164 1/20 0.45
GAA P10253 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HIF1A Q16665 1/20 0.45
FADS1 O60427 1/20 0.44
KCNMA1 Q12791 1/20 0.44
GRM5 P41594 1/20 0.44
PLA2G10 O15496 1/20 0.44
PHGDH O43175 1/20 0.44
F2 P00734 1/20 0.44
CA2 P00918 1/20 0.44

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
SCHEMBL11806114 0.87 PTGS1 (0.74) PTGS1PTGS2KDM4EMEN1KMT2A
SCHEMBL577155 0.86 PTGS1 (1.00) PTGS1PTGS2KDM4EMEN1KMT2A
SCHEMBL11808288 0.85 PTGS1 (0.75) PTGS1PTGS2KDM4EMEN1KMT2A
SCHEMBL11812145 0.85 PTGS1 (0.75) PTGS1PTGS2KDM4EMEN1KMT2A
SCHEMBL11810849 0.84 PTGS1 (0.78) PTGS1PTGS2KDM4EMEN1KMT2A
SCHEMBL11812573 0.84 PTGS1 (0.68) PTGS1PTGS2KDM4EMEN1KMT2A
SCHEMBL11810343 0.83 PTGS1 (0.72) PTGS1PTGS2KDM4EMEN1KMT2A
SCHEMBL11828660 0.83 PTGS1 (0.76) PTGS1PTGS2KDM4EMEN1KMT2A
SCHEMBL11817754 0.82 PTGS1 (0.74) PTGS1PTGS2KDM4EMEN1KMT2A
SCHEMBL11808423 0.82 PTGS1 (0.74) PTGS1PTGS2KDM4EMEN1KMT2A

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