SCHEMBL13523844

SCHEMBL13523844

CC(C)CCCCCCOc1ccc(-c2cc(C=O)ccc2C=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 1/20 0.48
▸ ALDH1A1 P00352 5/20 0.41
▸ MAPT P10636 3/20 0.41
▸ LMNA P02545 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ HTR1A P08908 1/20 0.36
▸ HTR1D P28221 1/20 0.36
▸ HTR1B P28222 1/20 0.36
▸ ERN1 O75460 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ MAOB P27338 2/20 0.35
▸ MGAM O43451 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ SI P14410 1/20 0.35
▸ MGAM2 Q2M2H8 1/20 0.35
▸ HDAC8 Q9BY41 1/20 0.34
▸ ALDH1A3 P47895 1/20 0.34

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
SCHEMBL1446758 0.90 FDPS (0.41) RARBALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL7139442 0.86 RARB (0.47) RARBALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL31498248 0.83 ALDH1A1 (0.57) RARBALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL7283005 0.79 RARB (0.56) RARBALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL27364677 0.77 RARB (0.49) RARBALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL19018472 0.77 ALDH1A1 (0.60) RARBALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL2859226 0.74 GSTO1 (0.40) RARBALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL3068736 0.74 TDP1 (0.54) RARBALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL7289924 0.73 ALDH1A1 (0.45) RARBALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL10653441 0.73 FDPS (0.43) RARBALDH1A1MAPTHPGDTDP1

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-20100001263-A1 POLYMER COMPOUND AND LIGHT EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-01-07 — — US disclosed
US-20100001263-A1 POLYMER COMPOUND AND LIGHT EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-01-07 — — US disclosed
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