SCHEMBL7500815

SCHEMBL7500815

O=C1C=CC(=O)N1N1CCOCC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.37
HTT P42858 2/20 0.37
TP53 P04637 1/20 0.37
STAT3 P40763 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GPR55 Q9Y2T6 1/20 0.37
GAA P10253 2/20 0.36
KDM4E B2RXH2 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
MAPK1 P28482 1/20 0.36
S100A4 P26447 1/20 0.35
LMNA P02545 3/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
APAF1 O14727 1/20 0.34
NPC1 O15118 1/20 0.34
TDP2 O95551 1/20 0.34
NSD2 O96028 1/20 0.34
RAB9A P51151 1/20 0.34
GALK1 P51570 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
SCHEMBL28703626 0.75 ALDH1A1 (0.43) TDP1LMNAKMT2AMEN1APAF1
SCHEMBL13016515 0.70 KDM4E (0.41) MAPTSMN1; SMN2GAAKDM4ETDP1
SCHEMBL11110160 0.70 KMT2A (0.47) MAPTSMN1; SMN2GAATDP1S100A4
SCHEMBL11661363 0.68 HTR1A (0.43) MAPTGAAKDM4ETDP1MAPK1
SCHEMBL24120011 0.67 MGLL (0.48) MAPTHTTTP53SMN1; SMN2GPR55
SCHEMBL3795749 0.67 MGLL (0.41) MAPTHTTTP53STAT3SMN1; SMN2
SCHEMBL28365598 0.67 ALDH1A1 (0.54) MAPTHTTTP53SMN1; SMN2GPR55
SCHEMBL236146 0.66 MGLL (0.47) TP53SMN1; SMN2KDM4ELMNAKMT2A
SCHEMBL157324 0.66 MGLL (0.50) MAPTHTTTP53SMN1; SMN2GPR55
SCHEMBL3436867 0.66 ALDH1A1 (0.69) MAPTHTTTP53KDM4ETDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0871630-B1 4a,5a,8a,8b-TETRAHYDRO-6H-PYRROLO 3,4':4,5]FURO(3,2-b)PYRIDINE-6,8 7H]-DIONE DERIVATIVES FOR USE IN CONTROLLING ENDOPARASITES AND A METHOD OF PRODUCING SAID DERIVATIVES BAYER AG (DE) 2002-01-02 EP disclosed
US-6291472-B1 4a, 5a, 8a, 8b-tetrahydro-6H-pyrrolo[3′,4′:4, 5]furo[3,2-b] pyri-dine-6,8(7H)-dione derivatives for control of endoparasites processes for their preparation BAYER AKTIENGESELLSCHAFT (DE) 2001-09-18 US disclosed
US-6110928-A HUMAN OR VETERINARY MEDICINE BAYER AKTIENGESELLSCHAFT (DE) 2000-08-29 US disclosed
EP-0871630-A1 4a,5a,8a,8b-TETRAHYDRO-6H-PYRROLO 3,4':4,5]FURO(3,2-b)PYRIDINE-6,8 7H]-DIONE DERIVATIVES FOR USE IN CONTROLLING ENDOPARASITES AND A METHOD OF PRODUCING SAID DERIVATIVES BAYER AG (DE) 1998-10-21 EP disclosed
WO-1997014695-A1 4a,5a,8a,8b-TETRAHYDRO-6H-PYRROLO[3,4':4,5]FURO(3,2-b)PYRIDINE-6,8[7H]-DIONE DERIVATIVES FOR USE IN CONTROLLING ENDOPARASITES AND A METHOD OF PRODUCING SAID DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 1997-04-24 WO disclosed