SCHEMBL28852607

SCHEMBL28852607

CCCCC(=O)OC(=O)c1ccc(N(C)C)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.53
HSD17B10 Q99714 3/20 0.53
LMNA P02545 2/20 0.53
CYP3A4 P08684 1/20 0.53
HDAC3 O15379 1/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC2 Q92769 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
HDAC11 Q96DB2 1/20 0.47
HPGD P15428 7/20 0.47
MAPT P10636 7/20 0.47
RAB9A P51151 7/20 0.46
NPC1 O15118 6/20 0.46
KDM4E B2RXH2 5/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
MAPK1 P28482 3/20 0.46
TSHR P16473 3/20 0.46
GAA P10253 2/20 0.46
MCL1 Q07820 2/20 0.44
L3MBTL1 Q9Y468 2/20 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
SCHEMBL11373328 0.90 ALDH1A1 (0.49) ALDH1A1HSD17B10LMNACYP3A4HDAC3
SCHEMBL5838704 0.87 ALDH1A1 (0.45) ALDH1A1HSD17B10LMNACYP3A4HDAC11
SCHEMBL16174817 0.85 ALDH1A1 (0.53) ALDH1A1HSD17B10LMNACYP3A4HDAC3
SCHEMBL9016067 0.82 HSD17B3 (0.51) ALDH1A1LMNAMAPTRAB9ANPC1
SCHEMBL22655275 0.82 HSD17B3 (0.51) ALDH1A1LMNAMAPTRAB9ANPC1
SCHEMBL10652248 0.81 LMNA (0.61) ALDH1A1LMNACYP3A4MAPTRAB9A
SCHEMBL27200589 0.81 HTR7 (0.62) LMNACYP3A4HDAC3HDAC1HDAC2
SCHEMBL6511114 0.81 ALDH1A1 (0.46) ALDH1A1LMNACYP3A4HDAC3HDAC1
SCHEMBL1535709 0.80 CES2 (0.56) ALDH1A1LMNAMAPTKDM4ETSHR
SCHEMBL9699014 0.79 ALDH1A1 (0.64) ALDH1A1HSD17B10LMNACYP3A4HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116472027-A Polymer/hydrophobic ester oil blends 美国陶氏有机硅公司 2023-07-21 CN claimed
CN-115003388-A Aqueous sunscreen formulations based on sulfated crystalline cellulose SPF boosters 陶氏环球技术有限责任公司 2022-09-02 CN claimed
CN-116322627-A Skin care formulations 陶氏环球技术有限责任公司 2023-06-23 CN disclosed
CN-115701980-A Methods of making and using skin moisturizing formulations 罗门哈斯公司 2023-02-14 CN disclosed
CN-115003388-A Aqueous sunscreen formulations based on sulfated crystalline cellulose SPF boosters 陶氏环球技术有限责任公司 2022-09-02 CN disclosed