SCHEMBL2335798

SCHEMBL2335798

N=C(N)NCCOCCO

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.46
MAPK1 P28482 1/20 0.46
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
CYP1A2 P05177 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HIF1A Q16665 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ALOX15 P16050 1/20 0.32
THRB P10828 1/20 0.31
HTT P42858 1/20 0.31
MAPT P10636 1/20 0.31
ATG4B Q9Y4P1 1/20 0.31
KCNH3 Q9ULD8 1/20 0.30

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
SCHEMBL6412590 0.98 MEN1 (0.48) TSHRMAPK1MEN1KMT2ACYP1A2
Hydrochloric Acid SCHEMBL17022780 0.98 TSHR (0.43) TSHRMAPK1MEN1KMT2ACYP1A2
Hydrochloric Acid SCHEMBL28182299 0.96 MEN1 (0.46) TSHRMAPK1MEN1KMT2ACYP1A2
Succinic Acid SCHEMBL6236115 0.87 TSHR (0.34) TSHRMAPK1MEN1KMT2ASMN1; SMN2
SCHEMBL17030096 0.87 MEN1 (0.37) TSHRMAPK1MEN1KMT2ACYP1A2
SCHEMBL17030098 0.87 TSHR (0.42) TSHRMAPK1MEN1KMT2ACYP1A2
SCHEMBL17029957 0.84
SCHEMBL4093678 0.84 TSHR (0.39) TSHRMAPK1MEN1KMT2A
SCHEMBL4099643 0.82 MEN1 (0.41) TSHRMAPK1MEN1KMT2ATHRB
Hydrochloric Acid SCHEMBL27293499 0.82 TSHR (0.37) TSHRMAPK1MEN1KMT2A

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 60 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0805674-B1 SKIN AND HAIR COSMETIC COMPOSITIONS KAO CORP (JP) 2003-03-12 EP claimed
US-6348200-B1 OXYALKYLAMIDE OR AMINE DERIVATIVES;AT LEAST ONE OF POLYHYDRIC ALCOHOLS, OR VEGETABLE EXTRACTS, OR ORGANIC ACIDS; IMPROVES WATER-RETAINING ABILITY OF HORNY LAYER, CURES ROUGHNESS AND PREVENTS WRINKLES KAO CORPORATION (JP) 2002-02-19 US claimed
US-6187955-B1 A MOISTURIZER FOR SOFTENING SKINS; USEFUL AS COMPONENTS OF COSMETIC FORMULATIONS KAO CORPORATION (JP) 2001-02-13 US claimed
EP-0805674-A1 SKIN AND HAIR COSMETIC COMPOSITIONS Kao Corporation (JP) 1997-11-12 EP claimed
WO-1997014401-A1 SKIN AND HAIR COSMETIC COMPOSITIONS KAO CORPORATION (JP) 1997-04-24 WO claimed
JP-8092054-A None JP disclosed
JP-10287541-A None JP disclosed
JP-11217316-A None JP disclosed
JP-9095477-A None JP disclosed
EP-3861971-B1 ABSORBENT ARTICLE KAO CORP (JP) 2023-12-27 EP disclosed
CN-112689492-B Absorbent article 花王株式会社 2022-06-28 CN disclosed
EP-3861971-A1 ABSORBENT ARTICLE Kao Corporation (JP) 2021-08-11 EP disclosed
EP-0872228-A1 COSMETOLOGICAL METHODS Kao Corporation (JP) 1998-10-21 EP disclosed
US-5723133-A GUANIDINE WITH ORGANIC ACID FOR SKIN SOFTENING KAO CORPORATION (JP) 1998-03-03 US disclosed
CN-1166135-A Cosmetic compsns. KAO CORP (JP) 1997-11-26 CN disclosed
EP-0805674-A1 SKIN AND HAIR COSMETIC COMPOSITIONS Kao Corporation (JP) 1997-11-12 EP disclosed
WO-1997014401-A1 SKIN AND HAIR COSMETIC COMPOSITIONS KAO CORPORATION (JP) 1997-04-24 WO disclosed
JP-H0995477-A GUANIDINE DERIVATIVE AND ITS PRODUCTION KAO CORP 1997-04-08 JP disclosed
CN-1127249-A Guanidine derivatives, process for producing granidine derivatives and cosmetics containing guanidine derivatives KAO CORP (JP) 1996-07-24 CN disclosed
JP-H0892054-A SKIN COSMETIC KAO CORP 1996-04-09 JP disclosed