SCHEMBL11629765

SCHEMBL11629765

CCN(c1ccc(N=O)cc1)C(C)N1CCOCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.42
▸ ALDH1A1 P00352 6/20 0.39
▸ MAPT P10636 6/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ MAPK1 P28482 3/20 0.37
▸ TSHR P16473 2/20 0.37
▸ TP53 P04637 1/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ NR1H2 P55055 1/20 0.36
▸ NR1H3 Q13133 1/20 0.36
▸ SLC2A1 P11166 1/20 0.35
▸ KDM4E B2RXH2 4/20 0.35
▸ MLYCD O95822 1/20 0.34
▸ HTT P42858 2/20 0.34
▸ LMNA P02545 2/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ L3MBTL1 Q9Y468 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
SCHEMBL6696875 0.82 ALDH1A1 (0.40) GAAALDH1A1MAPTNPC1RAB9A
SCHEMBL15018955 0.74 ALDH1A1 (0.50) ALDH1A1MAPTSMN1; SMN2MAPK1TSHR
SCHEMBL6696798 0.74 S100B (0.47) GAAALDH1A1MAPTNPC1RAB9A
SCHEMBL17858561 0.71 ALDH1A1 (0.47) GAAALDH1A1MAPTMAPK1TSHR
SCHEMBL11629767 0.70 GAA (0.51) GAAALDH1A1MAPTNPC1RAB9A
SCHEMBL7031493 0.70 SMN1; SMN2 (0.34) ALDH1A1MAPTRAB9ASMN1; SMN2MAPK1
Hydrochloric Acid SCHEMBL11450008 0.67 ALDH1A1 (0.42) GAAALDH1A1MAPTMAPK1TSHR
SCHEMBL6705808 0.67 ALDH1A1 (0.42) GAAALDH1A1MAPTNPC1RAB9A
SCHEMBL19623616 0.67 ALDH1A1 (0.42) GAAALDH1A1MAPTMAPK1TSHR
SCHEMBL150647 0.64 LMNA (0.52) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2

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-4093806-A HAIR DYES L'OREAL (FR) 1978-06-06 — — US disclosed
US-4046786-A HAIR DYES L'OREAL (FR) 1977-09-06 — — US disclosed
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