SCHEMBL19084264

SCHEMBL19084264

CCCC1(C)c2ccccc2Cc2ccccc21

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 4/20 0.66
HTR2C P28335 2/20 0.38
DRD2 P14416 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
CHRM2 P08172 1/20 0.38
ADRA2A P08913 1/20 0.38
HRH1 P35367 1/20 0.37
HTR2B P41595 1/20 0.37
ALOX12 P18054 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
KDM1A O60341 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
SCHEMBL19084269 0.89 HTR2A (0.61) HTR2AHTR2CDRD2SLC6A2SLC6A4
SCHEMBL22870080 0.77 PGR (0.40) HTR2A
SCHEMBL8816862 0.73 HTR2A (0.61) HTR2AHTR2CDRD2SLC6A2SLC6A4
SCHEMBL29901667 0.73 HTR2A (0.61) HTR2AHTR2CDRD2SLC6A2SLC6A4
SCHEMBL28167584 0.73 HTR2A (0.47) HTR2AHTR2CDRD2SLC6A2SLC6A4
SCHEMBL11994185 0.72 ALOX5 (0.35) HTR2A
SCHEMBL28950833 0.72 HTR2A (0.59) HTR2AHTR2CDRD2SLC6A2SLC6A4
SCHEMBL30843843 0.72 HTR2A (0.59) HTR2AHTR2CDRD2SLC6A2SLC6A4
SCHEMBL13672458 0.70 HTR2A (0.57) HTR2AHTR2CDRD2SLC6A2SLC6A4
SCHEMBL20143949 0.68 HTR2A (0.55) HTR2AHTR2CDRD2SLC6A2SLC6A4

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-2017115978-A1 ORGANIC FILM COMPOSITION AND PATTERN FORMING METHOD 삼성에스디아이 주식회사 2017-07-06 WO disclosed