SCHEMBL20527740

SCHEMBL20527740

NCCCCC(NC(=O)CNC(=O)C(CCCCN)NC(=O)C1CCCN1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CPB2 Q96IY4 9/20 0.43
HDAC3 O15379 2/20 0.40
HDAC1 Q13547 2/20 0.40
HDAC2 Q92769 2/20 0.40
HDAC10 Q969S8 2/20 0.40
HDAC11 Q96DB2 2/20 0.40
HDAC8 Q9BY41 2/20 0.40
HDAC6 Q9UBN7 2/20 0.40
DPP7 Q9UHL4 1/20 0.40
NCOR2 Q9Y618 1/20 0.40
NMT1 P30419 4/20 0.40
NMT2 O60551 3/20 0.40
SLC6A5 Q9Y345 1/20 0.39

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
SCHEMBL30680482 0.91 MEN1 (0.46) MEN1KMT2ACPB2DPP7SLC6A5
SCHEMBL31433298 0.89 MEN1 (0.45) MEN1KMT2ACPB2DPP7SLC6A5
SCHEMBL10793309 0.89 ITGB3 (0.44) MEN1KMT2ACPB2HDAC3HDAC1
SCHEMBL10793294 0.89 ITGB3 (0.44) MEN1KMT2ACPB2HDAC3HDAC1
SCHEMBL6383815 0.89 GHSR (0.51) CPB2HDAC3HDAC1HDAC2HDAC10
SCHEMBL6383820 0.89 GHSR (0.51) CPB2HDAC3HDAC1HDAC2HDAC10
SCHEMBL29679975 0.89 GHSR (0.49) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL29381549 0.89 CPB2 (0.46) MEN1KMT2ACPB2DPP7
SCHEMBL8729043 0.89 CPB2 (0.46) MEN1KMT2ACPB2DPP7
SCHEMBL23303426 0.89 MEN1 (0.48) MEN1KMT2ACPB2DPP7

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
EP-3609465-A1 COSMETIC COMPOSITIONS The Procter and Gamble Company (US) 2020-02-19 EP disclosed
CN-110573133-A Cosmetic composition 宝洁公司 2019-12-13 CN disclosed
WO-2018191106-A1 COSMETIC COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2018-10-18 WO disclosed
US-20180289602-A1 Cosmetic Compositions THE PROCTER & GAMBLE COMPANY 2018-10-11 US disclosed