SCHEMBL28543665

SCHEMBL28543665

CCCCOC(=O)C(NCC)OC(=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 5/20 0.49
▸ TSHR P16473 6/20 0.48
▸ TDP1 Q9NUW8 3/20 0.48
▸ L3MBTL1 Q9Y468 3/20 0.48
▸ MAPK1 P28482 3/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ CYP1A2 P05177 2/20 0.46
▸ CYP2C19 P33261 2/20 0.46
▸ ESR1 P03372 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ NR1H2 P55055 1/20 0.46
▸ RNASEL Q05823 1/20 0.46
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ CYP3A4 P08684 3/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ PDE4D Q08499 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ HPGD P15428 1/20 0.44

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
SCHEMBL28277989 0.91 LMNA (0.48) LMNATSHRTDP1L3MBTL1MAPK1
SCHEMBL28279373 0.88 LMNA (0.50) LMNATSHRTDP1L3MBTL1MAPK1
SCHEMBL28555774 0.86 NPC1 (0.49) LMNATSHRMAPK1SMN1; SMN2MEN1
SCHEMBL28543670 0.81 ALDH1A1 (0.44) LMNATSHRTDP1L3MBTL1SMN1; SMN2
SCHEMBL28278004 0.79 LMNA (0.53) LMNATSHRTDP1L3MBTL1MAPK1
SCHEMBL28555902 0.78 HTR1A (0.48) LMNATSHRTDP1MAPK1SMN1; SMN2
SCHEMBL27470299 0.78 LMNA (0.51) LMNATSHRTDP1L3MBTL1MAPK1
SCHEMBL28278037 0.78 NPC1 (0.53) LMNATSHRTDP1L3MBTL1MAPK1
SCHEMBL28277993 0.78 LMNA (0.51) LMNATSHRTDP1L3MBTL1MAPK1
SCHEMBL28978386 0.77 LMNA (0.79) LMNATSHRTDP1L3MBTL1MAPK1

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-109553705-B Catalyst component for olefin polymerization and preparation method thereof 中国石油化工股份有限公司 2021-04-13 — — CN disclosed
CN-109553712-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-03-16 — — CN disclosed
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