SCHEMBL10470792

SCHEMBL10470792

CC(C)OP(O)OCCc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.39
TSHR P16473 2/20 0.39
LMNA P02545 1/20 0.38
NPC1 O15118 1/20 0.37
RECQL P46063 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TDP1 Q9NUW8 2/20 0.37
HPGD P15428 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
HCAR2 Q8TDS4 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
SCHEMBL3792731 0.83 IDO1 (0.48) IDO1TSHRLMNANPC1RECQL
SCHEMBL7334884 0.82 TSHR (0.41) IDO1TSHRLMNAHPGDCA1
SCHEMBL2129084 0.75 TDP1 (0.46) IDO1TSHRLMNANPC1RAB9A
SCHEMBL9941450 0.75 IDO1 (0.41) IDO1LMNANPC1RECQLRAB9A
SCHEMBL17360726 0.74 IDO1 (0.57) IDO1LMNANPC1RECQLRAB9A
Methyl Alcohol SCHEMBL28147273 0.72 TSHR (0.44) IDO1TSHRTDP1HPGDCA1
SCHEMBL10701795 0.72 TDP1 (0.47) IDO1TSHRLMNANPC1RECQL
SCHEMBL92354 0.71 CA1 (0.44) IDO1TSHRNPC1RAB9AHPGD
SCHEMBL3789208 0.71 CA1 (0.47) IDO1TSHRNPC1RAB9ASMN1; SMN2
SCHEMBL236727 0.71 MAOA (0.43) IDO1TSHRSMN1; 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-4910238-A Photostable polyvinyl chloride ADEKA ARGUS CHEMICAL CO. LTD. (JP) 1990-03-20 US disclosed
US-3991139-A NORBORNENE DERIVATIVES, PHENOLS, ESTER THIOETHERS SHOWA DENKO KABUSHIKI KAISHA (JA) 1976-11-09 US disclosed