SCHEMBL28620127

SCHEMBL28620127

C=CC(C)(P)CCC=C(C)C

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 6/20 0.63
HIF1A Q16665 4/20 0.44
EPAS1 Q99814 4/20 0.44
TSHR P16473 1/20 0.40
KMT2A Q03164 4/20 0.34
MEN1 O00255 3/20 0.33
CYP3A4 P08684 3/20 0.33
MAPK1 P28482 1/20 0.33
CHRNA7 P36544 1/20 0.33
STAT3 P40763 1/20 0.33
ALDH1A1 P00352 3/20 0.31
MAPT P10636 2/20 0.31
UGT1A1 P22309 1/20 0.31
SQLE Q14534 2/20 0.31

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
SCHEMBL8144735 0.79 ALOX15 (0.65) ALOX15HIF1AEPAS1TSHRKMT2A
SCHEMBL10603830 0.79 ALOX15 (0.65) ALOX15HIF1AEPAS1TSHRKMT2A
Linalool (+) SCHEMBL901244 0.77 ALOX15 (1.00) ALOX15HIF1AEPAS1TSHRKMT2A
Linalool SCHEMBL254425 0.77 ALOX15 (1.00) ALOX15HIF1AEPAS1TSHRKMT2A
SCHEMBL28184173 0.77 ALOX15 (0.63) ALOX15HIF1AEPAS1TSHRKMT2A
Linalool SCHEMBL29481111 0.77 ALOX15 (1.00) ALOX15HIF1AEPAS1TSHRKMT2A
Linalool SCHEMBL988357 0.77 ALOX15 (1.00) ALOX15HIF1AEPAS1TSHRKMT2A
Linalool SCHEMBL20316 0.77 ALOX15 (1.00) ALOX15HIF1AEPAS1TSHRKMT2A
Linalool (+) SCHEMBL891312 0.77 ALOX15 (1.00) ALOX15HIF1AEPAS1TSHRKMT2A
Linalool SCHEMBL25377128 0.76 ALOX15 (0.96) ALOX15HIF1AEPAS1TSHRKMT2A

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
CN-113347969-A Composition for eliminating senescent cells 维也纳自然资源与生命科学大学 2021-09-03 CN claimed
CN-113347969-A Composition for eliminating senescent cells 维也纳自然资源与生命科学大学 2021-09-03 CN disclosed