SCHEMBL10694839

SCHEMBL10694839

Cc1cc(C)c2c(c1)C(=O)c1c(C)ccc(C)c1C2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.43
AKT2 P31751 1/20 0.43
AKT3 Q9Y243 1/20 0.43
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
TYMS P04818 1/20 0.38
ALDH1A1 P00352 5/20 0.34
MAPK1 P28482 3/20 0.34
CYP3A4 P08684 2/20 0.34
TSHR P16473 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
NPC1 O15118 1/20 0.34
CASP3 P42574 1/20 0.34
RAB9A P51151 1/20 0.34
HBB P68871 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
METAP1 P53582 1/20 0.34
TTR P02766 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
SCHEMBL6056997 0.77 AKT1 (0.46) AKT1AKT2AKT3MEN1KMT2A
SCHEMBL8212525 0.71 AKT1 (0.51) AKT1AKT2AKT3ALDH1A1MAPK1
SCHEMBL6906767 0.71 MAOA (0.55) MEN1KMT2AALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL11611425 0.71 ELANE (0.51) MEN1KMT2AALDH1A1MAPK1CYP3A4
SCHEMBL3984329 0.71 ACHE (0.40) MEN1KMT2AALDH1A1MAPK1CYP3A4
SCHEMBL6903907 0.70 MAOA (0.53) AKT1AKT2AKT3MEN1KMT2A
SCHEMBL11605912 0.70 MAOA (0.47) AKT1AKT2AKT3MEN1KMT2A
SCHEMBL28491870 0.70 AKT1 (0.42) AKT1AKT2AKT3ALDH1A1TSHR
SCHEMBL8688881 0.69 ALDH1A1 (0.42) MEN1KMT2ATYMSALDH1A1TSHR
SCHEMBL8688884 0.69 ALDH1A1 (0.42) MEN1KMT2ATYMSALDH1A1TSHR

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-4792551-A 9-anthryloxyaminoalkanes and related compounds as anti-inflammatory and analgetic agents SYNTEX (U.S.A.) INC. (US) 1988-12-20 US disclosed
EP-0132351-A2 9-Anthryloxyaminoalkanes and related compounds, processes for their preparation and pharmaceutical compositions containing them SYNTEX (U.S.A.) INC. (US) 1985-01-30 EP disclosed