SCHEMBL6402457

SCHEMBL6402457

Oc1c2cccc1Cc1cccc(c1O)C(CCl)c1cccc(c1O)Cc1cccc(c1O)C2

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 16/20 0.41
HRH1 P35367 10/20 0.40
HTR2C P28335 2/20 0.40
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
PNMT P11086 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
SCHEMBL15541504 0.79 HTR2A (0.44) HTR2AHRH1HTR2CSLC6A2SLC6A4
SCHEMBL15540909 0.75 HTR2A (0.39) HTR2AHRH1HTR2C
SCHEMBL29383145 0.74 ALDH1A1 (0.48) HTR2A
SCHEMBL29644944 0.74 ALDH1A1 (0.48) HTR2A
SCHEMBL1471552 0.74 ALDH1A1 (0.48) HTR2A
SCHEMBL2471777 0.74 ALDH1A1 (0.48) HTR2A
SCHEMBL29366399 0.74 ALDH1A1 (0.48) HTR2A
SCHEMBL29469562 0.74 ALDH1A1 (0.48) HTR2A
SCHEMBL12168748 0.74 ALDH1A1 (0.48) HTR2A
SCHEMBL19113839 0.68 TSHR (0.43)

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-20050008976-A1 Method of manufacturing an electronic device HITACHI, LTD. (JP) 2005-01-13 US disclosed