SCHEMBL11499652

SCHEMBL11499652

C=CCc1cccc(Cc2cccc3c2[nH]c2ccccc23)c1O

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
MAPK1 P28482 2/20 0.50
NPC1 O15118 1/20 0.50
LMNA P02545 1/20 0.50
POLB P06746 1/20 0.50
HTT P42858 1/20 0.50
RAB9A P51151 1/20 0.50
GABRA1 P14867 1/20 0.46
GABRB2 P47870 1/20 0.46
KIF11 P52732 4/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
AKR1B1 P15121 1/20 0.38
GAA P10253 2/20 0.38
PARP14 Q460N5 4/20 0.37
PKM P14618 1/20 0.36

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
SCHEMBL241852 0.85 KIF11 (0.49) MAPTMAPK1NPC1LMNAPOLB
SCHEMBL29376743 0.85 KIF11 (0.49) MAPTMAPK1NPC1LMNAPOLB
Ammonia Solution, Strong SCHEMBL28918843 0.84 KIF11 (0.47) MAPTMAPK1NPC1LMNAPOLB
SCHEMBL28876207 0.84 KIF11 (0.47) MAPTMAPK1NPC1LMNAPOLB
SCHEMBL11141346 0.81 KIF11 (0.57) MAPTMAPK1LMNAHTTGABRA1
SCHEMBL836026 0.79 GABRA1 (0.70) MAPTMAPK1LMNAHTTGABRA1
SCHEMBL27880326 0.78 KIF11 (0.45) MAPTMAPK1NPC1LMNAPOLB
SCHEMBL8095421 0.77 KIF11 (0.44) MAPTMAPK1NPC1LMNAPOLB
SCHEMBL28398379 0.77 TDO2 (0.43) MAPTMAPK1NPC1LMNAPOLB
SCHEMBL27830682 0.74 MAPK1 (0.44) MAPTMAPK1NPC1LMNAPOLB

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-4298481-A DIALKYL ESTER OF HYDROGENATED DIMER ACIDS AND ADDITIVES TENNECO CHEMICALS, INC. (US) 1981-11-03 US claimed
US-4298481-A DIALKYL ESTER OF HYDROGENATED DIMER ACIDS AND ADDITIVES TENNECO CHEMICALS, INC. (US) 1981-11-03 US disclosed