SCHEMBL8809227

SCHEMBL8809227

COc1ccc(N2CCN(CC(=O)O)CC2)cc1

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.65
KMT2A Q03164 5/20 0.65
GFER P55789 1/20 0.64
HTR1A P08908 1/20 0.61
GAA P10253 2/20 0.61
DRD2 P14416 2/20 0.60
POLB P06746 1/20 0.60
REV1 Q9UBZ9 1/20 0.60
P4HB P07237 1/20 0.60
TSHR P16473 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.59
LMNA P02545 1/20 0.58
HTR2A P28223 1/20 0.57

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
Hydrochloric Acid SCHEMBL1373077 0.98 MEN1 (0.64) MEN1KMT2AGFERHTR1AGAA
SCHEMBL4393525 0.86 MEN1 (0.64) MEN1KMT2AGFERHTR1AGAA
SCHEMBL10770280 0.86 MEN1 (0.64) MEN1KMT2AGFERHTR1AGAA
SCHEMBL5011458 0.85 KMT2A (0.75) MEN1KMT2AGFERHTR1ADRD2
SCHEMBL7370493 0.83 MAPT (0.57) MEN1KMT2AGFERPOLBREV1
SCHEMBL13234976 0.83 MAPT (0.67) MEN1KMT2AHTR1AGAAPOLB
SCHEMBL3161414 0.82 KMT2A (0.67) MEN1KMT2AGFERHTR1ADRD2
Hydrochloric Acid SCHEMBL1373869 0.82 GFER (0.67) MEN1KMT2AGFERDRD2TSHR
SCHEMBL26373091 0.82 S1PR1 (0.61) MEN1KMT2AGFERGAAREV1
SCHEMBL2881604 0.82 MAPT (0.66) MEN1KMT2AHTR1AGAAPOLB

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-0717733-B1 FUSED TRICYCLIC HETEROAROMATIC DERIVATIVES AS DOPAMINE RECEPTOR SUBTYPE LIGANDS MERCK SHARP & DOHME (GB) 1997-12-03 EP disclosed
US-5686480-A Fused tricyclic heteroaromatic derivatives as dopamine receptor subtype ligands MERCK, SHARP & DOHME, LTD. (GB) 1997-11-11 US disclosed
EP-0717733-A1 FUSED TRICYCLIC HETEROAROMATIC DERIVATIVES AS DOPAMINE RECEPTOR SUBTYPE LIGANDS MERCK SHARP & DOHME LTD. (GB) 1996-06-26 EP disclosed
WO-1995007262-A1 FUSED TRICYCLIC HETEROAROMATIC DERIVATIVES AS DOPAMINE RECEPTOR SUBTYPE LIGANDS MERCK SHARP & DOHME LIMITED (GB) 1995-03-16 WO disclosed