SCHEMBL8045802

SCHEMBL8045802

CCCOCCCc1ccccn1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 2/20 0.50
HRH3 Q9Y5N1 2/20 0.47
CYP2D6 P10635 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP3A4 P08684 1/20 0.47
ALDH1A1 P00352 3/20 0.46
LMNA P02545 1/20 0.46
TAAR1 Q96RJ0 1/20 0.46
ALOX15 P16050 1/20 0.46
CYP1A2 P05177 4/20 0.44
CYP2C19 P33261 3/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HRH4 Q9H3N8 1/20 0.43
NAAA Q02083 1/20 0.43
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL14305751 0.93 CYP2D6 (0.50) HRH1HRH3CYP2D6CYP2C9CYP3A4
SCHEMBL7445422 0.91 HRH1 (0.58) HRH1HRH3CYP2D6CYP2C9CYP3A4
SCHEMBL1826443 0.89 HRH1 (0.50) HRH1HRH3CYP2D6ALDH1A1LMNA
SCHEMBL7449242 0.85 HRH1 (0.61) HRH1HRH3CYP2D6CYP2C9CYP3A4
SCHEMBL29263687 0.84 HRH1 (0.71) HRH1HRH3CYP2D6CYP2C9CYP3A4
SCHEMBL7449958 0.84 HRH1 (0.65) HRH1HRH3CYP2D6CYP2C9CYP3A4
SCHEMBL1807177 0.84 HRH1 (0.65) HRH1HRH3CYP2D6CYP2C9CYP3A4
SCHEMBL7452998 0.84 HRH1 (0.65) HRH1HRH3CYP2D6CYP2C9CYP3A4
SCHEMBL7448741 0.84 HRH1 (0.65) HRH1HRH3CYP2D6CYP2C9CYP3A4
SCHEMBL8906069 0.83 HRH1 (0.50) HRH1HRH3CYP2D6CYP2C9CYP3A4

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
EP-0989205-A1 METAL PASTE AND METHOD FOR PRODUCTION OF METAL FILM Takamatsu Research Laboratory (JP) 2000-03-29 EP disclosed