SCHEMBL7741575

SCHEMBL7741575

c1cc2c(cc1C[C]1CCCC1)OCO2

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 4/20 0.55
SLC6A4 P31645 3/20 0.53
CYP3A4 P08684 2/20 0.53
CYP1A2 P05177 1/20 0.53
MAPT P10636 1/20 0.53
CYP2D6 P10635 2/20 0.51
SLC6A2 P23975 2/20 0.51
SLC6A3 Q01959 2/20 0.51
DPP7 Q9UHL4 1/20 0.50
CMA1 P23946 1/20 0.50

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
SCHEMBL7741367 0.98 TAAR1 (0.53) TAAR1SLC6A4CYP3A4CYP1A2MAPT
SCHEMBL7738598 0.98 TAAR1 (0.53) TAAR1SLC6A4CYP3A4CYP1A2MAPT
SCHEMBL7739741 0.98 TAAR1 (0.53) TAAR1SLC6A4CYP3A4CYP1A2MAPT
SCHEMBL7739774 0.98 TAAR1 (0.53) TAAR1SLC6A4CYP3A4CYP1A2MAPT
SCHEMBL7739721 0.98 TAAR1 (0.53) TAAR1SLC6A4CYP3A4CYP1A2MAPT
SCHEMBL109195 0.86 TAAR1 (0.64) TAAR1SLC6A4CYP3A4CYP1A2MAPT
SCHEMBL108109 0.84 TAAR1 (0.62) TAAR1SLC6A4CYP3A4CYP1A2MAPT
SCHEMBL108065 0.78 CALM1 (0.62) TAAR1SLC6A4CYP3A4CYP1A2MAPT
SCHEMBL28771804 0.78 TAAR1 (0.51) TAAR1SLC6A4CYP3A4CYP1A2MAPT
SCHEMBL108087 0.77 TAAR1 (0.77) TAAR1SLC6A4CYP3A4CYP1A2MAPT

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
US-6410748-B1 Alicycli c group-containing monomer KABUSHIKI KAISHA TOSHIBA (JP) 2002-06-25 US disclosed
US-6291129-B1 LIGHT SENSITIVE ELEMENT WITH UNSATURATED POLYMERS KABUSHIKI KAISHA TOSHIBA (JP) 2001-09-18 US disclosed