SCHEMBL14062574

SCHEMBL14062574

Fc1ccc(C2CCC(OCC3CO3)CC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HCRTR2 O43614 4/20 0.42
▸ SLC18A3 Q16572 2/20 0.37
▸ HTR1A P08908 2/20 0.36
▸ DRD2 P14416 2/20 0.36
▸ HTR2A P28223 2/20 0.36
▸ DRD3 P35462 2/20 0.36
▸ DRD1 P21728 1/20 0.36
▸ DRD5 P21918 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ GLA P06280 1/20 0.35
▸ USP5 P45974 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ GPR119 Q8TDV5 2/20 0.33

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
SCHEMBL14062735 0.96 HCRTR2 (0.40) HCRTR2SLC18A3HTR1ADRD2HTR2A
SCHEMBL14062803 0.96 HCRTR2 (0.40) HCRTR2SLC18A3HTR1ADRD2HTR2A
SCHEMBL14062893 0.92 HCRTR2 (0.39) HCRTR2SLC18A3HTR1ADRD2HTR2A
SCHEMBL14062674 0.88 HCRTR2 (0.38) HCRTR2SLC18A3HTR1ADRD2HTR2A
SCHEMBL14062732 0.85 HCRTR2 (0.36) HCRTR2SLC18A3HTR1ADRD2HTR2A
SCHEMBL14062793 0.85 HCRTR2 (0.36) HCRTR2SLC18A3HTR1ADRD2HTR2A
SCHEMBL14062585 0.84 DRD2 (0.43) HCRTR2SLC18A3HTR1ADRD2HTR2A
SCHEMBL14062639 0.84 ALDH1A1 (0.38) HCRTR2SLC18A3ALDH1A1GLAUSP5
SCHEMBL14062805 0.84 KMT2A (0.41) HCRTR2DRD2ALDH1A1USP5
SCHEMBL14062607 0.84 HCRTR2 (0.45) HCRTR2HTR2AALDH1A1USP5TDP1

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
US-7425354-B2 Photopolymerizable liquid crystal composition, its polymer or polymer composition, and optical compensation element CHISSO CORPORATION (JP) 2008-09-16 — — US disclosed
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