SCHEMBL17281124

SCHEMBL17281124

C=c1c2cccc3cccc(c(=O)n1CCCCCC(C)C)c32

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.46
▸ TDP1 Q9NUW8 10/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ TSHR P16473 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ KEAP1 Q14145 1/20 0.34
▸ NFE2L2 Q16236 1/20 0.34
▸ TLR9 Q9NR96 1/20 0.34
▸ CNR2 P34972 1/20 0.34
▸ PGR P06401 1/20 0.34
▸ RORA P35398 1/20 0.34
▸ RORC P51449 1/20 0.34
▸ RORB Q92753 1/20 0.34
▸ RXRA P19793 2/20 0.34
▸ MPO P05164 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
SCHEMBL17281122 1.00 ALDH1A1 (0.46) ALDH1A1TDP1L3MBTL1TSHRSMN1; SMN2
SCHEMBL22182105 0.82 TDP1 (0.57) ALDH1A1TDP1L3MBTL1TSHRSMN1; SMN2
SCHEMBL8086180 0.78 FAAH (0.45) ALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL16577621 0.70 ALDH1A1 (0.80) ALDH1A1TDP1L3MBTL1TSHRSMN1; SMN2
SCHEMBL14169090 0.70 KMT2A (0.41) ALDH1A1HSD17B10
SCHEMBL17694147 0.70 HEXA (0.64) ALDH1A1SMN1; SMN2HSD17B10
SCHEMBL20099136 0.70 HEXA (0.64) ALDH1A1SMN1; SMN2HSD17B10
SCHEMBL19455723 0.69 AHR (0.35) ALDH1A1TDP1L3MBTL1TSHRSMN1; SMN2
SCHEMBL15423266 0.67 SLC6A4 (0.58) ALDH1A1TDP1SMN1; SMN2PGRRORA
SCHEMBL8961377 0.67 DHFR (0.48) ALDH1A1TSHRSMN1; SMN2HSD17B10

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-9960294-B2 Highly fluorescent and photo-stable chromophores for wavelength conversion NITTO DENKO CORPORATION (JP) 2018-05-01 — — US disclosed
US-20150340519-A1 HIGHLY-FLUORESCENT AND PHOTO-STABLE CHROMOPHORES FOR WAVELENGTH CONVERSION NITTO DENKO CORPORATION (JP) 2015-11-26 — — US disclosed
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