SCHEMBL11817658

SCHEMBL11817658

O=C(NN1C(=O)c2c(Br)c(Br)c(Br)c(Br)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 8/20 0.50
▸ GAA P10253 2/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ MPO P05164 1/20 0.50
▸ HIF1A Q16665 1/20 0.50
▸ MEN1 O00255 5/20 0.49
▸ KMT2A Q03164 5/20 0.49
▸ HPGD P15428 4/20 0.49
▸ MAPT P10636 4/20 0.49
▸ ALDH1A1 P00352 3/20 0.49
▸ USP2 O75604 1/20 0.49
▸ NPC1 O15118 5/20 0.48
▸ RAB9A P51151 3/20 0.48
▸ HTT P42858 4/20 0.46
▸ RECQL P46063 1/20 0.46
▸ P2RX1 P51575 1/20 0.46
▸ LMNA P02545 4/20 0.42
▸ TP53 P04637 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
SCHEMBL11812121 0.88 PTGS1 (0.68) PTGS1PTGS2KDM4EGAASMN1; SMN2
SCHEMBL11812518 0.86 PTGS1 (0.73) PTGS1PTGS2KDM4EGAASMN1; SMN2
SCHEMBL11806473 0.82 PTGS1 (0.68) PTGS1PTGS2KDM4EGAASMN1; SMN2
SCHEMBL11812573 0.82 PTGS1 (0.68) PTGS1PTGS2KDM4EGAASMN1; SMN2
SCHEMBL11803258 0.82 PTGS1 (0.68) PTGS1PTGS2KDM4EGAASMN1; SMN2
SCHEMBL11808770 0.82 PTGS1 (0.68) PTGS1PTGS2KDM4EGAASMN1; SMN2
SCHEMBL11806351 0.82 PTGS1 (0.68) PTGS1PTGS2KDM4EGAASMN1; SMN2
SCHEMBL11806081 0.82 PTGS1 (0.68) PTGS1PTGS2KDM4EGAASMN1; SMN2
SCHEMBL577155 0.81 PTGS1 (1.00) PTGS1PTGS2KDM4EGAASMN1; SMN2
SCHEMBL11811601 0.78 PTGS1 (0.62) PTGS1PTGS2KDM4EGAASMN1; SMN2

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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