SCHEMBL11744667

SCHEMBL11744667

CCC(Oc1ccc(C(C)(C)CC)cc1C(C)(C)CC)C(=O)Nc1ccc(Cl)c(NC(=O)C(C(=O)c2ccco2)N2C(=O)C3CCCN3C2=O)c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.33
TP53 P04637 5/20 0.33
SMN1; SMN2 Q16637 4/20 0.32
MAPT P10636 4/20 0.32
KMT2A Q03164 4/20 0.32
ALDH1A1 P00352 4/20 0.32
LYPLA1 O75608 1/20 0.32
NPC1 O15118 3/20 0.31
RAB9A P51151 3/20 0.31
MEN1 O00255 3/20 0.31
LMNA P02545 4/20 0.31
MAPK1 P28482 2/20 0.31
USP2 O75604 1/20 0.31
TSHR P16473 1/20 0.31
NPSR1 Q6W5P4 2/20 0.30
NFKB1 P19838 1/20 0.30
CASP1 P29466 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 1/20 0.30
MCOLN3 Q8TDD5 1/20 0.30

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
SCHEMBL11747486 0.90 MEN1 (0.34) KMT2AALDH1A1MEN1LMNANPSR1
SCHEMBL11744322 0.88 ACKR3 (0.34) SMN1; SMN2KMT2AALDH1A1MEN1LMNA
SCHEMBL11745978 0.87 ACKR3 (0.35) MAPTKMT2AALDH1A1RAB9AMEN1
SCHEMBL11819038 0.81 MAPT (0.34) TDP1TP53SMN1; SMN2MAPTKMT2A
SCHEMBL11748078 0.81 TSHR (0.36) MAPTKMT2AALDH1A1NPC1RAB9A
SCHEMBL11748701 0.78 ALDH1A1 (0.34) SMN1; SMN2MAPTKMT2AALDH1A1MEN1
SCHEMBL14037169 0.77 APOBEC3A (0.31) MAPTKMT2AALDH1A1MEN1LMNA
SCHEMBL11744320 0.76 ALDH1A1 (0.36) SMN1; SMN2MAPTKMT2AALDH1A1MEN1
SCHEMBL14437612 0.76 MEN1 (0.32) SMN1; SMN2MAPTKMT2AALDH1A1MEN1
SCHEMBL14011128 0.75 SLC16A3 (0.32) KMT2AALDH1A1MEN1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4012259-A DICARBONYL METHYLENE GROUP ON A 2,5-DIOXO-1-IMIDAZOLIDINE IS A YELLOW COUPLER FUJI PHOTO FILM CO., LTD. (JA) 1977-03-15 US disclosed