SCHEMBL10079800

SCHEMBL10079800

CC1CC(C)C(c2ccccc2)CCCC1C=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRIA4 P48058 2/20 0.38
▸ HPGD P15428 1/20 0.37
▸ HRH3 Q9Y5N1 2/20 0.36
▸ MAOA P21397 6/20 0.35
▸ MAOB P27338 6/20 0.35
▸ KDM1A O60341 4/20 0.35
▸ CYP2C19 P33261 4/20 0.35
▸ CYP2B6 P20813 3/20 0.35
▸ CYP1A2 P05177 2/20 0.35
▸ CYP2D6 P10635 2/20 0.35
▸ CYP2C9 P11712 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ HTR1A P08908 1/20 0.35
▸ ADRA2A P08913 1/20 0.35
▸ CYP2A6 P11509 1/20 0.35
▸ SLC6A2 P23975 1/20 0.35
▸ HTR2C P28335 1/20 0.35
▸ ADRA1A P35348 1/20 0.35
▸ DRD3 P35462 1/20 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
SCHEMBL12208421 0.81 MEN1 (0.42) GRIA4HPGDMAOAMAOBKDM1A
SCHEMBL27945836 0.76 SLC18A3 (0.49) GRIA4HPGDHRH3MAOAMAOB
SCHEMBL16830132 0.75 MEN1 (0.46) GRIA4MAOAMAOBKDM1ACYP2C19
SCHEMBL16830133 0.75 MEN1 (0.46) GRIA4MAOAMAOBKDM1ACYP2C19
SCHEMBL325104 0.75 MEN1 (0.46) GRIA4MAOAMAOBKDM1ACYP2C19
SCHEMBL16830124 0.75 MEN1 (0.46) GRIA4MAOAMAOBKDM1ACYP2C19
SCHEMBL16830122 0.75 MEN1 (0.46) GRIA4MAOAMAOBKDM1ACYP2C19
SCHEMBL446482 0.72 MAOB (0.48) HPGDMAOAMAOBKDM1ACYP2C19
SCHEMBL16762126 0.72 MAOB (0.48) HPGDMAOAMAOBKDM1ACYP2C19
SCHEMBL446481 0.72 MAOB (0.48) HPGDMAOAMAOBKDM1ACYP2C19

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-2012044719-A1 NORBORNANE-BASED PAC BALLAST AND POSITIVE-TONE PHOTOSENSITIVE RESIN COMPOSITION ENCOMPASSING THE PAC PROMERUS LLC (US) 2012-04-05 — — WO disclosed
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