SCHEMBL5225815

SCHEMBL5225815

Cc1cc(Br)ccc1CCCCCCCCN

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PYCR1 P32322 1/20 0.41
TAAR1 Q96RJ0 4/20 0.37
CHEK1 O14757 1/20 0.36
HTR2A P28223 2/20 0.36
TRPM8 Q7Z2W7 1/20 0.36
MPO P05164 2/20 0.36
HRH1 P35367 2/20 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
SCHEMBL29890016 0.85 TAAR1 (0.52) PYCR1TAAR1CHEK1HTR2ATRPM8
SCHEMBL20425681 0.85 TAAR1 (0.52) PYCR1TAAR1CHEK1HTR2ATRPM8
Hydrochloric Acid SCHEMBL29507155 0.83 TAAR1 (0.50) PYCR1TAAR1CHEK1HTR2ATRPM8
Hydrochloric Acid SCHEMBL7637186 0.83 TAAR1 (0.50) PYCR1TAAR1CHEK1HTR2ATRPM8
SCHEMBL11337231 0.81 TAAR1 (0.50) PYCR1TAAR1HTR2AMPO
SCHEMBL11338772 0.81 TAAR1 (0.50) PYCR1TAAR1HTR2AMPO
SCHEMBL11325501 0.81 TAAR1 (0.50) PYCR1TAAR1HTR2AMPO
SCHEMBL11331960 0.81 TAAR1 (0.50) PYCR1TAAR1HTR2AMPO
SCHEMBL11329915 0.81 TAAR1 (0.50) PYCR1TAAR1HTR2AMPO
SCHEMBL11331972 0.81 TAAR1 (0.50) PYCR1TAAR1HTR2AMPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1394158-B1 Thiophene derivatives and optical elements using the same FUJIFILM CORP (JP) 2007-03-21 EP disclosed
EP-1394158-A1 Novel compounds and optical elements using the same FUJI PHOTO FILM CO., LTD. (JP) 2004-03-03 EP disclosed