SCHEMBL11211947

SCHEMBL11211947

NCCCC1OCc2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 8/20 0.53
HRH1 P35367 3/20 0.53
SLC6A2 P23975 4/20 0.40
SLC6A4 P31645 3/20 0.40
CYP2D6 P10635 2/20 0.40
HTR2C P28335 4/20 0.38
RET P07949 1/20 0.38
ADRA2A P08913 1/20 0.37
ADRA2B P18089 1/20 0.37
ADRA2C P18825 1/20 0.37
ADRA1D P25100 1/20 0.37
ADRA1A P35348 1/20 0.37
ADRA1B P35368 1/20 0.37
HTR2B P41595 3/20 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
SCHEMBL7405300 0.89 HTR2A (0.50) HTR2AHRH1SLC6A2SLC6A4CYP2D6
SCHEMBL7270702 0.83 OPRM1 (0.40) HTR2AHRH1SLC6A2SLC6A4CYP2D6
SCHEMBL1702059 0.83 HTT (0.46) HTR2AHRH1SLC6A2SLC6A4CYP2D6
SCHEMBL7271568 0.83 HTT (0.36) HTR2AHRH1SLC6A2SLC6A4CYP2D6
SCHEMBL6790140 0.82 ADRA2A (0.53) HTR2AHRH1SLC6A2SLC6A4CYP2D6
SCHEMBL5497052 0.81 HTT (0.45) HTR2ASLC6A2SLC6A4CYP2D6HTR2C
SCHEMBL9683908 0.74 LMNA (0.40) SLC6A2SLC6A4CYP2D6ADRA2AADRA2B
SCHEMBL17193849 0.74 LMNA (0.40) SLC6A2SLC6A4CYP2D6ADRA2AADRA2B
SCHEMBL7271833 0.74 SLC6A2 (0.37) HTR2AHRH1SLC6A2SLC6A4CYP2D6
SCHEMBL28758384 0.74 SLC6A2 (0.40) SLC6A2SLC6A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4417052-A ANTIINFLAMMATORY AGENTS; ANALGESICS; VIRICIDES STERLING DRUG INC. (US) 1983-11-22 US disclosed
US-4308382-A ANTIINFLAMMATORY AGENTS STERLING DRUG INC. (US) 1981-12-29 US disclosed
US-4216326-A Intermediates for preparing anti-inflammatory phenyl-lower-alkylamines STERLING DRUG INC. (US) 1980-08-05 US disclosed
US-4080380-A 2-Naphthyl-lower-alkylamines STERLING DRUG INC. (US) 1978-03-21 US disclosed
US-4069256-A Anti-inflammatory phenyl-lower-alkylamines STERLING DRUG INC. (US) 1978-01-17 US disclosed
US-4028366-A ANTIINFLAMMATORY AGENTS STERLING DRUG INC. (US) 1977-06-07 US disclosed
US-4008276-A ANTIINFLAMMATORY STERLING DRUG INC. (US) 1977-02-15 US disclosed
US-4005093-A ANTI-INFLAMMATORY AGENTS STERLING DRUG INC. (US) 1977-01-25 US disclosed
US-3965105-A ANTIINFLAMMATORY STERLING DRUG INC. (US) 1976-06-22 US disclosed