SCHEMBL28564004

SCHEMBL28564004

CCCCCC(CC)OC(=O)C=Cc1ccc(C)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.46
MAOB P27338 1/20 0.44
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA7 P43166 2/20 0.43
CA9 Q16790 2/20 0.43
CA14 Q9ULX7 2/20 0.43
AKR1B10 O60218 1/20 0.43
AKR1B1 P15121 1/20 0.43
APP P05067 5/20 0.42
MAPT P10636 1/20 0.41
RAB9A P51151 2/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 2/20 0.39
CYP3A4 P08684 1/20 0.39
FOS P01100 1/20 0.39
JUN P05412 1/20 0.39
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39

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
SCHEMBL19137922 0.90 CA12 (0.57) TDP1MAOBCA12CA1CA2
SCHEMBL3222440 0.88 EGFR (0.49) TDP1MAOBAKR1B10AKR1B1KMT2A
SCHEMBL3222436 0.88 EGFR (0.49) TDP1MAOBAKR1B10AKR1B1KMT2A
SCHEMBL14698300 0.87 TDP1 (0.62) TDP1MAOBMAPTKMT2ALMNA
SCHEMBL14645365 0.87 TAS1R3 (0.52) TDP1MAOBMAPTRAB9AKMT2A
SCHEMBL35994 0.87 TDP1 (0.62) TDP1MAOBMAPTKMT2ALMNA
SCHEMBL35995 0.87 TDP1 (0.62) TDP1MAOBMAPTKMT2ALMNA
SCHEMBL119065 0.87 EGFR (0.51) TDP1MAOBAKR1B10AKR1B1APP
SCHEMBL11015347 0.86 HSD17B3 (0.48) TDP1MAOBCA12CA1CA2
SCHEMBL11015346 0.86 HSD17B3 (0.48) TDP1MAOBCA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115006311-B Transparent double-phase sun-screening composition and preparation method thereof 浙江宜格企业管理集团有限公司 2024-03-26 CN disclosed
CN-112156035-B Sun-proof stick and preparation method thereof 上海中翊日化有限公司 2022-10-21 CN disclosed
CN-115006311-A Transparent two-phase sunscreen composition and preparation method thereof 浙江宜格企业管理集团有限公司 2022-09-06 CN disclosed
CN-112156035-A Sun-proof stick and preparation method thereof 上海中翊日化有限公司 2021-01-01 CN disclosed