SCHEMBL21167279

SCHEMBL21167279

Cc1ccc(OCCC2(c3ccccc3)OCCO2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.44
DRD4 P21917 5/20 0.44
DRD3 P35462 5/20 0.44
HTR1A P08908 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.41
ADRA1D P25100 1/20 0.40
HPGD P15428 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
KCNA5 P22460 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
KCNH2 Q12809 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL23964575 0.79 L3MBTL1 (0.35) DRD2DRD4HTR1AL3MBTL1ALDH1A1
SCHEMBL384387 0.78 CA12 (0.38) ALDH1A1CYP2C19SMN1; SMN2
SCHEMBL11611623 0.77 LTA4H (0.42) DRD2DRD4DRD3HTR1ASMN1; SMN2
SCHEMBL171652 0.76 DRD2 (0.43) DRD2DRD4DRD3L3MBTL1HPGD
SCHEMBL7504793 0.75 PKM (0.55) L3MBTL1ALDH1A1TSHRMAPK1
SCHEMBL7500004 0.75 MAPT (0.60) L3MBTL1NPSR1ALDH1A1CYP1A2CYP3A4
SCHEMBL28217421 0.73 HTR1A (0.43) HTR1AL3MBTL1ADRA1DMAOAMAOB
SCHEMBL13172004 0.72 TSHR (0.45) L3MBTL1MAOAMAOBTSHRMAPK1
SCHEMBL9339661 0.72 TSHR (0.38) HTR1AL3MBTL1ADRA1DALDH1A1CYP1A2
SCHEMBL17309118 0.71 KCNA3 (0.47) HTR1AL3MBTL1ADRA1DALDH1A1MAOA

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-2439070-B1 Infrared-sensitive positive-working image forming material, planographic printing plate precursor, and method for manufacturing a planographic printing plate FUJIFILM CORP (JP) 2019-07-17 EP disclosed