SCHEMBL28495753

SCHEMBL28495753

CCC(C)c1ccc(OP(O)(O)=S)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
TSHR P16473 2/20 0.50
GAA P10253 3/20 0.49
MAPT P10636 3/20 0.49
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
HPGD P15428 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP2C9 P11712 1/20 0.39
HSP90AA1 P07900 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
USP2 O75604 1/20 0.39
PKM P14618 1/20 0.39
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39
SLC7A5 Q01650 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL10947292 0.82 ALDH1A1 (0.46) ALDH1A1TSHRGAAMAPTMEN1
SCHEMBL8020054 0.82 ALDH1A1 (0.46) ALDH1A1TSHRGAAMAPTMEN1
SCHEMBL12716935 0.82 BLM (0.54) ALDH1A1TSHRGAAMAPTMEN1
SCHEMBL28674354 0.81 SMN1; SMN2 (0.41) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL10785258 0.81 ALDH1A1 (0.45) ALDH1A1TSHRGAAMAPTMEN1
SCHEMBL8016148 0.80 ALDH1A1 (0.46) ALDH1A1TSHRGAAMAPTMEN1
SCHEMBL8020056 0.79 ALDH1A1 (0.44) ALDH1A1TSHRGAAMAPTMEN1
SCHEMBL1790600 0.78 TSHR (0.53) ALDH1A1TSHRGAAMAPTMEN1
SCHEMBL8942284 0.74 ALDH1A1 (0.43) ALDH1A1TSHRGAAMAPTMEN1
Hydrogen Peroxide SCHEMBL11434421 0.73 ALDH1A1 (0.59) ALDH1A1TSHRGAAMAPTNPC1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112041416-B Lubricating oil composition 丰田自动车株式会社 2022-09-06 CN disclosed
CN-114867827-A Lubricating oil composition for automobile gears 壳牌润滑油日本株式会社 2022-08-05 CN disclosed
CN-113631692-A Grease composition 出光兴产株式会社 2021-11-09 CN disclosed
CN-105164238-B Lubricating oil composition 出光兴产株式会社 2021-06-29 CN disclosed
CN-112041416-A Lubricating oil composition 丰田自动车株式会社 2020-12-04 CN disclosed