SCHEMBL31398488

SCHEMBL31398488

CC(C)(C)C(Oc1ccccc1O)(C(C)(C)C)C(C)(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.52
TP53 P04637 2/20 0.52
CA2 P00918 2/20 0.52
CA1 P00915 1/20 0.52
LMNA P02545 3/20 0.43
MAPT P10636 3/20 0.43
GAA P10253 3/20 0.43
JAK2 O60674 1/20 0.43
ALDH1A1 P00352 5/20 0.41
TDP1 Q9NUW8 2/20 0.41
HSD11B1 P28845 1/20 0.41
HSD17B3 P37058 1/20 0.41
KDM4E B2RXH2 3/20 0.40
HSD17B10 Q99714 3/20 0.40
CYP3A4 P08684 2/20 0.40
HPGD P15428 2/20 0.40
ALOX15 P16050 2/20 0.40
ALOX12 P18054 1/20 0.40
MAPK1 P28482 1/20 0.40
NPC1 O15118 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
SCHEMBL1805490 0.86 CA2 (0.56) TSHRTP53CA2CA1LMNA
SCHEMBL28056177 0.78 TSHR (0.52) TSHRTP53CA2CA1LMNA
SCHEMBL11002065 0.78 TSHR (0.52) TSHRTP53CA2CA1LMNA
Propene SCHEMBL28274957 0.78 TSHR (0.47) TSHRTP53CA2CA1LMNA
SCHEMBL15616284 0.75 TSHR (0.48) TSHRTP53CA2CA1LMNA
SCHEMBL16173839 0.75 TSHR (0.48) TSHRTP53CA2CA1LMNA
SCHEMBL27210420 0.75 ALDH1A1 (0.52) TSHRTP53CA2CA1LMNA
SCHEMBL2917048 0.75 TSHR (0.48) TSHRTP53CA2CA1LMNA
SCHEMBL10891083 0.75 ALDH1A1 (0.54) TSHRTP53CA2CA1LMNA
SCHEMBL9359773 0.75 TSHR (0.48) TSHRTP53CA2CA1LMNA

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-119463943-A Color follow-up sealant for neutral ink ball pen and preparation method thereof 杭州赛亨科技有限公司 2025-02-18 CN claimed
CN-119432475-A Follow-up sealant for neutral ink ball pen and preparation method thereof 杭州赛亨科技有限公司 2025-02-14 CN claimed
CN-119463943-A Color follow-up sealant for neutral ink ball pen and preparation method thereof 杭州赛亨科技有限公司 2025-02-18 CN disclosed
CN-119432475-A Follow-up sealant for neutral ink ball pen and preparation method thereof 杭州赛亨科技有限公司 2025-02-14 CN disclosed