SCHEMBL77727

SCHEMBL77727

CCCC(CC)C(=O)Oc1ccccc1CCO

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.42
THRB P10828 1/20 0.42
TSHR P16473 2/20 0.41
ALDH1A1 P00352 1/20 0.41
NPSR1 Q6W5P4 2/20 0.36
GAA P10253 1/20 0.36
XBP1 P17861 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PTGES O14684 1/20 0.35
ALOX5 P09917 1/20 0.35
PPARG P37231 1/20 0.35
MTNR1A P48039 1/20 0.35
MTNR1B P49286 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
SCHEMBL28008288 0.88 TSHR (0.45) THRATHRBTSHRALDH1A1NPSR1
SCHEMBL17961061 0.83 TSHR (0.53) THRATHRBTSHRALDH1A1NPSR1
SCHEMBL27993666 0.81 ALOX15 (0.44) THRATHRBNPSR1CYP4F2CYP4A11
SCHEMBL16672991 0.80 TSHR (0.48) TSHRALDH1A1NPSR1GAAXBP1
SCHEMBL15548894 0.78 SMN1; SMN2 (0.46) TSHRALDH1A1NPSR1SMN1; SMN2
SCHEMBL16672613 0.78 L3MBTL1 (0.49) TSHRALDH1A1NPSR1GAAXBP1
SCHEMBL8573202 0.77 THRA (0.46) THRATHRBNPSR1L3MBTL1CYP4F2
SCHEMBL17938465 0.76 CA2 (0.56) TSHRALDH1A1NPSR1GAAXBP1
SCHEMBL28818302 0.76 ATM (0.51) TSHRALDH1A1NPSR1GAAXBP1
SCHEMBL16672594 0.76 PPARG (0.47) TSHRALDH1A1NPSR1GAAXBP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8129308-B2 Thermal transfer image-receiving sheet and surface condition improver FUJIFILM CORPORATION (JP) 2012-03-06 US disclosed
US-20090087552-A1 METHOD OF PRODUCING HEAT-SENSITIVE TRANSFER IMAGE-RECEIVING SHEET FUJIFILM CORPORATION (JP) 2009-04-02 US disclosed
US-20090011154-A1 THERMAL TRANSFER IMAGE-RECEIVING SHEET AND SURFACE CONDITION IMPROVER FUJIFILM CORPORATION (JP) 2009-01-08 US disclosed