SCHEMBL6913596

SCHEMBL6913596

Oc1ccc2c(c1)-c1ccccc1COCc1ccccc1O2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.52
MAPT P10636 2/20 0.52
ALDH1A1 P00352 2/20 0.52
MAOB P27338 2/20 0.39
MAOA P21397 1/20 0.39
NPC1 O15118 1/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TYR P14679 1/20 0.36
TRPA1 O75762 1/20 0.35
MEN1 O00255 2/20 0.35
HPGD P15428 2/20 0.35
KMT2A Q03164 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
AR P10275 1/20 0.35
CYP2C19 P33261 1/20 0.35
HTT P42858 1/20 0.35
RECQL P46063 1/20 0.35
BLM P54132 1/20 0.35
SMAD3 P84022 1/20 0.35

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
SCHEMBL8136557 0.80 ALDH1A1 (0.76) RAB9AMAPTALDH1A1MAOBMAOA
SCHEMBL24042749 0.78 CDK5 (0.46) RAB9AMAPTALDH1A1TYRTRPA1
SCHEMBL11404428 0.72 ALDH1A1 (0.69) RAB9AMAPTALDH1A1MAOBMAOA
SCHEMBL2929766 0.72 MAOA (0.54) RAB9AMAPTALDH1A1MAOBMAOA
SCHEMBL2530756 0.72 MAOA (0.65) RAB9AMAPTALDH1A1MAOBMAOA
SCHEMBL11850245 0.70 ALDH1A1 (0.61) RAB9AMAPTALDH1A1MAOBMAOA
SCHEMBL31253972 0.70 ALDH1A1 (0.61) RAB9AMAPTALDH1A1MAOBMAOA
SCHEMBL28164391 0.69 ALDH1A1 (0.59) RAB9AMAPTALDH1A1MAOBMAOA
SCHEMBL31408196 0.69 ALDH1A1 (0.59) RAB9AMAPTALDH1A1MAOBMAOA
SCHEMBL655741 0.69 MAPT (1.00) RAB9AMAPTALDH1A1NPC1SMN1; 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-6727294-B2 RADIATION TRANSPARENT MOLDING MATERIALS MITSUBISHI ENGINEERING-PLASTICS CORPORATION (JP) 2004-04-27 US disclosed
US-20010034419-A1 Radiation transparent molding materials MITSUBISHI ENGINEERING-PLASTICS CORPORATION (JP) 2001-10-25 US disclosed