SCHEMBL8633902

SCHEMBL8633902

c1ccc(CCN2CCN(Cn3ncc4ccccc43)CC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.55
P2RX7 Q99572 1/20 0.52
SLC6A3 Q01959 1/20 0.49
POLB P06746 1/20 0.48
HSD17B10 Q99714 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
HTR1A P08908 1/20 0.48
DRD2 P14416 1/20 0.48
SIGMAR1 Q99720 2/20 0.47
GRM2 Q14416 1/20 0.47
KMO O15229 1/20 0.47
CYP1A2 P05177 1/20 0.44
NOS3 P29474 1/20 0.44
NOS1 P29475 1/20 0.44
CASP1 P29466 1/20 0.44
CASP4 P49662 1/20 0.44
CASP5 P51878 1/20 0.44

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
SCHEMBL8631008 0.86 RECQL (0.67) RECQLP2RX7POLBHSD17B10L3MBTL1
SCHEMBL27566640 0.82 RECQL (0.69) RECQLP2RX7POLBKMOCYP1A2
SCHEMBL29520874 0.81 RECQL (0.53) RECQLP2RX7POLBHSD17B10L3MBTL1
SCHEMBL8633681 0.80 RECQL (0.50) RECQLP2RX7POLBHSD17B10L3MBTL1
SCHEMBL6977835 0.79 RECQL (0.51) RECQLP2RX7POLBHSD17B10L3MBTL1
SCHEMBL8628921 0.78 POLB (0.58) RECQLPOLBHSD17B10L3MBTL1KMO
SCHEMBL8627836 0.75 DRD4 (0.45) RECQLP2RX7POLBHSD17B10L3MBTL1
SCHEMBL13150782 0.74 SLC6A3 (0.83) SLC6A3HTR1ADRD2SIGMAR1
SCHEMBL14407778 0.74 SLC6A3 (0.83) SLC6A3HTR1ADRD2SIGMAR1
SCHEMBL6056974 0.74 SLC6A3 (0.83) SLC6A3HTR1ADRD2SIGMAR1

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-5780475-A Antipsychotic indazole derivatives MERCK, SHARP & DOHME LIMITED (GB) 1998-07-14 US disclosed