SCHEMBL6844539

SCHEMBL6844539

COc1ccc(-c2cn3ccc(OC)cc3c2C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.47
NPC1 O15118 5/20 0.47
RAB9A P51151 5/20 0.47
PKM P14618 2/20 0.47
ALDH1A1 P00352 3/20 0.45
POLB P06746 2/20 0.45
GAA P10253 2/20 0.45
HTT P42858 1/20 0.45
TLR9 Q9NR96 3/20 0.43
TLR7 Q9NYK1 3/20 0.43
QPCT Q16769 1/20 0.41
QPCTL Q9NXS2 1/20 0.41
GRIK1 P39086 1/20 0.40
GRIK2 Q13002 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
ABL1 P00519 1/20 0.40
ABCB1 P08183 1/20 0.40
BCR P11274 1/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
EPHX2 P34913 1/20 0.39

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
SCHEMBL19220371 0.89 HPGD (0.42) KDM4ENPC1RAB9APKMALDH1A1
SCHEMBL6640418 0.81 KDM4E (0.61) KDM4ENPC1RAB9APKMALDH1A1
SCHEMBL6846622 0.81 KDM4E (0.45) KDM4ENPC1RAB9APKMALDH1A1
SCHEMBL8204755 0.69 ALDH1A3 (0.44) KDM4ENPC1RAB9APKMALDH1A1
SCHEMBL17033291 0.69 ACHE (0.39) KDM4ENPC1RAB9APKMALDH1A1
SCHEMBL6641997 0.68 KDM4E (0.56) KDM4ENPC1RAB9APKMALDH1A1
SCHEMBL679848 0.66 SMN1; SMN2 (0.55) KDM4ENPC1RAB9AABL1ABCB1
SCHEMBL6638755 0.66 HRH3 (0.61) KDM4ENPC1RAB9APKMALDH1A1
SCHEMBL6635856 0.66 KDM4E (0.68) KDM4ENPC1RAB9APKMALDH1A1
SCHEMBL29511345 0.65 SMN1; SMN2 (0.53) KDM4ENPC1RAB9AHTTABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0986560-B1 PYRROLO 2,1,5-CD]INDOLIZINE DERIVATIVES USEFUL IN THE PREVENTION OR TREATMENT OF ESTROGEN RELATED DISEASES OR SYNDROMES KAROBIO AB (SE) 2004-03-24 EP disclosed
US-6075036-A Pyrrolo [2,1,5-cd] indolizine derivatives useful in the prevention or treatment of estrogen related diseases or syndromes NOVO NORDISK (DK) 2000-06-13 US disclosed
EP-0986560-A1 PYRROLO 2,1,5-CD]INDOLIZINE DERIVATIVES USEFUL IN THE PREVENTION OR TREATMENT OF ESTROGEN RELATED DISEASES OR SYNDROMES NOVO NORDISK A/S (DK) 2000-03-22 EP disclosed
WO-1998055482-A1 PYRROLO[2,1,5-CD]INDOLIZINE DERIVATIVES USEFUL IN THE PREVENTION OR TREATMENT OF ESTROGEN RELATED DISEASES OR SYNDROMES NOVO NORDISK A/S (DK) 1998-12-10 WO disclosed