SCHEMBL8530683

SCHEMBL8530683

Brc1cccc(C2[CH]CCCN2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 5/20 0.42
POLB P06746 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
RCOR1 Q9UKL0 1/20 0.35
DRD2 P14416 1/20 0.35
DRD1 P21728 1/20 0.35
DRD4 P21917 1/20 0.35
DRD5 P21918 1/20 0.35
DRD3 P35462 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
MBTD1 Q05BQ5 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
SCHEMBL8530249 0.80 HTR2A (0.37) KDM1AHTR2AHTR2CHTR2BKDM4E
SCHEMBL6227686 0.78 SLC18A3 (0.38) POLBHTR2BKDM4EHPGDNPC1
SCHEMBL472003 0.78 SLC18A3 (0.38) POLBHTR2BKDM4EHPGDNPC1
SCHEMBL8531187 0.75 ABCC9 (0.34) HPGDTSHR
SCHEMBL2527089 0.72 CHRNB2 (0.53) KDM1APOLBMEN1KMT2ADRD2
SCHEMBL29086568 0.72 CHRNB2 (0.53) KDM1APOLBMEN1KMT2ADRD2
SCHEMBL29884098 0.72 CHRNB2 (0.53) KDM1APOLBMEN1KMT2ADRD2
SCHEMBL29964556 0.72 CHRNB2 (0.53) KDM1APOLBMEN1KMT2ADRD2
Hydrochloric Acid SCHEMBL22498444 0.71 CHRNB2 (0.51) KDM1APOLBMEN1KMT2AHTR2A
Hydrochloric Acid SCHEMBL3725483 0.71 CHRNB2 (0.51) KDM1APOLBMEN1KMT2AHTR2A

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-5843966-A Piperidine derivatives GLAXO GROUP LIMITED (GB) 1998-12-01 US disclosed