SCHEMBL7563636

SCHEMBL7563636

CCOC(=O)c1ccc(Nc2ccc3c(c2)C(C)(C)OC3(C)C)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.52
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
THRB P10828 3/20 0.52
SLC2A1 P11166 1/20 0.52
HPGD P15428 3/20 0.50
RECQL P46063 1/20 0.50
PDPK1 O15530 1/20 0.48
MAPT P10636 4/20 0.47
NPC1 O15118 4/20 0.47
KDM4E B2RXH2 2/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
TP53 P04637 2/20 0.46
APAF1 O14727 1/20 0.46
MITF O75030 1/20 0.46
NR4A1 P22736 1/20 0.46
HTT P42858 1/20 0.46
SMAD3 P84022 1/20 0.46
HKDC1 Q2TB90 1/20 0.46
CA1 P00915 1/20 0.46

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
SCHEMBL12124929 0.80 RAB9A (0.69) RAB9AMEN1KMT2ATHRBSLC2A1
SCHEMBL7564779 0.78 RXRA (0.50) RAB9AMEN1KMT2AHPGDRECQL
SCHEMBL8116657 0.76 HPGD (0.43) RAB9AMEN1KMT2AHPGDRECQL
SCHEMBL7565539 0.76 RXRA (0.42) RAB9AHPGDRECQLMAPTNPC1
SCHEMBL9644563 0.76 RAB9A (0.63) RAB9AMEN1KMT2ATHRBSLC2A1
SCHEMBL28141853 0.75 RAB9A (0.67) RAB9AMEN1KMT2ATHRBSLC2A1
SCHEMBL6086102 0.75 MEN1 (0.47) RAB9AMEN1KMT2ATHRBSLC2A1
SCHEMBL7565083 0.75 RAB9A (0.47) RAB9AMEN1KMT2ATHRBSLC2A1
SCHEMBL9176722 0.74 SMN1; SMN2 (0.72) RAB9AMEN1KMT2ATHRBSLC2A1
SCHEMBL7570193 0.74 RAB9A (0.47) RAB9AMEN1KMT2ATHRBSLC2A1

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
EP-1228055-A1 DIHYDROAMINOBENZO[B]- AND [C]FURANS AS RETINOID-LIKE AGENTS Allergan Sales, Inc. (US) 2002-08-07 EP disclosed
WO-2001012618-A1 DIHYDROAMINOBENZO[B]- AND [C]FURANS AS RETINOID-LIKE AGENTS ALLERGAN SALES, INC. (US) 2001-02-22 WO disclosed
US-6093838-A FOR TREATING SKIN-RELATED DISEASES, INCLUDING ACTINIC KERATOSES, ARSENIC KERATOSES, ECZEMA ALLERGAN SALES, INC. (US) 2000-07-25 US disclosed