SCHEMBL8328664

SCHEMBL8328664

Oc1cc2c(cc1O)C[N]CC2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADCY6 O43306 1/20 0.44
ADCY3 O60266 1/20 0.44
ADCY9 O60503 1/20 0.44
ADCY5 O95622 1/20 0.44
ADCY8 P40145 1/20 0.44
ADCY7 P51828 1/20 0.44
ADCY2 Q08462 1/20 0.44
ADCY1 Q08828 1/20 0.44
ADCY4 Q8NFM4 1/20 0.44
MAPT P10636 3/20 0.38
ALDH1A1 P00352 2/20 0.38
HIF1A Q16665 2/20 0.38
HSD17B10 Q99714 2/20 0.38
NFKB1 P19838 1/20 0.38
THPO P40225 1/20 0.38
USP2 O75604 1/20 0.38
KDM4E B2RXH2 3/20 0.37
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
PKM P14618 1/20 0.37

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
SCHEMBL3245289 0.76 DRD2 (0.44) DRD2DRD1MAOADRD4DRD5
SCHEMBL29924694 0.73 ADCY6 (0.63) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL8851253 0.71 CHRNA7 (0.42) MAPTALDH1A1HSD17B10KDM4EMEN1
SCHEMBL9404859 0.68 ADCY6 (0.41) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL1535914 0.68 MAPT (0.59) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL6568351 0.68 MAPT (0.67) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL2836833 0.67 PDE4D (0.40) MAPTALDH1A1HSD17B10KDM4EMEN1
SCHEMBL3020052 0.67 PNMT (0.46) L3MBTL1ADRA2AADRA2BADRA2C
SCHEMBL586129 0.67 LMNA (0.38) MAPTALDH1A1HSD17B10KDM4EMEN1
SCHEMBL446278 0.67 LMNA (0.38) MAPTALDH1A1HSD17B10KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5925642-A ANTITUMOR, ANTIMETASTASIS AGENTS; DRUG RESISTANCE MODULATORS; SYNERGISTIC MIXTURES WITH ANTIBIOTICS AND CYTOSTATIC AGENTS; SIDE EFFECT REDUCTION BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1999-07-20 US disclosed
EP-0863899-A1 PYRIDOPYRIMIDINES Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1998-09-16 EP disclosed
US-5668131-A CONTROLLING HELICOBACTER BACTERIA BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1997-09-16 US disclosed
WO-1997028166-A1 THIENOQUINOLINES BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1997-08-07 WO disclosed
WO-1997019946-A1 PYRIDOPYRIMIDINES BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1997-06-05 WO disclosed
WO-1996000224-A1 4-S- AND N-SUBSTITUTED 6-ALKYLPYRIDINES FOR CONTROLLING HELICOBACTER BACTERIA BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1996-01-04 WO disclosed