SCHEMBL10475434

SCHEMBL10475434

C1=Cc2ccccc2C(C2CCNCC2)C1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 9/20 0.42
SLC18A3 Q16572 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
SLC6A2 P23975 7/20 0.38
SLC6A4 P31645 7/20 0.38
SLC6A3 Q01959 7/20 0.38
HTR1A P08908 6/20 0.38
ADRB2 P07550 1/20 0.35

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
SCHEMBL8878343 0.90 HTR2C (0.37) HTR2CSLC18A3SIGMAR1SLC6A2SLC6A4
SCHEMBL290887 0.83 HTR2A (0.39) HTR2CSIGMAR1
SCHEMBL7214849 0.80 HTR2A (0.40) HTR2CSLC6A2SLC6A3
Acetonitrile SCHEMBL28222988 0.79 CYP2D6 (0.31)
SCHEMBL7817402 0.75 HTR2C (0.43) HTR2CSLC18A3SIGMAR1SLC6A2SLC6A4
Hydrochloric Acid SCHEMBL10601800 0.74 HTR2C (0.45) HTR2CSLC18A3SIGMAR1SLC6A2SLC6A4
SCHEMBL30790640 0.70 HTR6 (0.33)
SCHEMBL1598816 0.70 HTR2C (0.39) HTR2CSLC18A3SIGMAR1SLC6A2SLC6A4
SCHEMBL17861414 0.70 HTR2C (0.42) HTR2CSLC18A3SIGMAR1SLC6A2SLC6A4
Phosphoric Acid SCHEMBL10597412 0.68 CYP2D6 (0.38) HTR2CSLC18A3SIGMAR1SLC6A2SLC6A4

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
WO-1990006303-A1 ARYLPIPERIDINE DERIVATIVES PFIZER INC. (US) 1990-06-14 WO disclosed