SCHEMBL7006378

SCHEMBL7006378

O=C(c1ccccc1Cl)n1cc(C2=CCN3CCC[C@@H]3C2)c2cc(F)ccc21

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 5/20 0.44
HSD11B1 P28845 2/20 0.38
ALDH1A1 P00352 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPT P10636 1/20 0.36
HCRTR1 O43613 3/20 0.36
HCRTR2 O43614 3/20 0.36
MEN1 O00255 1/20 0.35
KDM2B Q8NHM5 1/20 0.35
GAA P10253 1/20 0.34
RAB9A P51151 1/20 0.33
POLB P06746 1/20 0.33
SFRP1 Q8N474 1/20 0.33
CACNA1H O95180 1/20 0.33

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
SCHEMBL7006379 1.00 HTR6 (0.44) HTR6HSD11B1ALDH1A1KMT2AMAPT
SCHEMBL2064235 0.84 KDM2B (0.36) HTR6HSD11B1ALDH1A1KMT2AMAPT
SCHEMBL8385549 0.79 HTR6 (0.44) HTR6ALDH1A1KMT2AMEN1
SCHEMBL7485451 0.79 HTR6 (0.57) HTR6ALDH1A1KMT2AMAPT
SCHEMBL7005429 0.75 HTR6 (0.58) HTR6
SCHEMBL7005431 0.75 HTR6 (0.58) HTR6
SCHEMBL2064415 0.74 BTK (0.35) HTR6KDM2B
SCHEMBL7004526 0.74 HTR6 (0.59) HTR6
SCHEMBL7004521 0.74 HTR6 (0.59) HTR6
SCHEMBL3132568 0.74 HTR6 (0.41) HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1105393-B1 BICYCLIC PIPERIDINE AND PIPERAZINE COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY NPS ALLELIX CORP (CA) 2003-10-01 EP claimed
US-6251893-B1 TREATING CENTRAL NERVOUS SYSTEM DISORDERS NPS ALLELIX CORP. (CA) 2001-06-26 US claimed