SCHEMBL28541195

SCHEMBL28541195

CCCCC(CC)CC(O)C(O)CN(CCO)Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.44
▸ MAPT P10636 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ TSHR P16473 2/20 0.43
▸ POLB P06746 3/20 0.40
▸ HSD17B10 Q99714 2/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ HTT P42858 1/20 0.38
▸ APP P05067 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ NPC1 O15118 1/20 0.35
▸ CSNK1E P49674 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL28793291 0.81 ALDH1A1 (0.42) ALDH1A1MAPTGAAMAPK1TSHR
SCHEMBL8281048 0.81 ALDH1A1 (0.53) ALDH1A1MAPTGAAMAPK1TSHR
SCHEMBL28793243 0.79 ALDH1A1 (0.38) ALDH1A1MAPTGAAMAPK1TSHR
SCHEMBL8543593 0.78 ALDH1A1 (0.46) ALDH1A1MAPTGAAMAPK1TSHR
SCHEMBL28473501 0.77 ALDH1A1 (0.46) ALDH1A1MAPTGAAMAPK1TSHR
SCHEMBL28221097 0.76 ALDH1A1 (0.47) ALDH1A1MAPTMAPK1TSHRPOLB
SCHEMBL9052714 0.75 ALDH1A1 (0.59) ALDH1A1MAPTGAAMAPK1TSHR
Hydrochloric Acid SCHEMBL30154993 0.75 ALDH1A1 (0.56) ALDH1A1MAPTGAAMAPK1TSHR
SCHEMBL2228445 0.75 ALDH1A1 (0.58) ALDH1A1MAPTGAAMAPK1TSHR
SCHEMBL30814400 0.74 POLB (0.40) ALDH1A1MAPTGAAMAPK1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114651023-B Hydrophobically modified alkylene oxide polymer mixtures 罗门哈斯公司 2024-05-03 — — CN claimed
CN-114651023-B Hydrophobically modified alkylene oxide polymer mixtures 罗门哈斯公司 2024-05-03 — — CN disclosed
CN-112239609-B Associative thickeners without biocides 罗门哈斯公司 2023-08-15 — — CN disclosed
CN-114651023-A Hydrophobically modified alkylene oxide polymer blends 罗门哈斯公司 2022-06-21 — — CN disclosed
CN-114554852-A Composition of rheology modifier and dihalohydantoin 罗门哈斯公司 2022-05-27 — — CN disclosed
CN-112239609-A Associative thickeners free of biocides 罗门哈斯公司 2021-01-19 — — CN disclosed
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