SCHEMBL1955764

SCHEMBL1955764

NC(=S)NN(C(=O)C=O)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
TDP1 Q9NUW8 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
RAB9A P51151 1/20 0.37
TP53 P04637 1/20 0.36
TYR P14679 1/20 0.36
TSHR P16473 1/20 0.36
TAS2R38 P59533 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CHIA Q9BZP6 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MITF O75030 1/20 0.35
PAX8 Q06710 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
TRPM8 Q7Z2W7 1/20 0.34
MAPK1 P28482 1/20 0.33
CA1 P00915 1/20 0.33

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
SCHEMBL10558444 0.73 TP53 (0.51) ALDH1A1TDP1L3MBTL1HTTSMN1; SMN2
SCHEMBL10564707 0.72 ALDH1A1 (0.61) ALDH1A1TDP1L3MBTL1HTTSMN1; SMN2
SCHEMBL3797066 0.70 KMT2A (0.59) ALDH1A1L3MBTL1HTTSMN1; SMN2TP53
SCHEMBL9615041 0.70 ALDH1A1 (0.40) ALDH1A1HTTSMN1; SMN2TP53TYR
SCHEMBL10939138 0.69 TDP1 (0.39) ALDH1A1TDP1L3MBTL1HTTSMN1; SMN2
SCHEMBL9082914 0.69 ALDH1A1 (0.50) ALDH1A1L3MBTL1SMN1; SMN2TP53TYR
SCHEMBL11669536 0.69 NPSR1 (0.48) ALDH1A1TDP1L3MBTL1HTTRAB9A
SCHEMBL11598307 0.68 ALDH1A1 (0.41) ALDH1A1TDP1HTTSMN1; SMN2TP53
SCHEMBL8006032 0.68 TRPM8 (0.59) ALDH1A1TDP1L3MBTL1HTTSMN1; SMN2
SCHEMBL12980512 0.67 TDP1 (0.47) ALDH1A1TDP1L3MBTL1HTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114774053-A Adhesive compositions and methods 沙特阿美技术公司 2022-07-22 CN disclosed
CN-110791246-B Adhesive composition and method 沙特阿美技术公司 2022-04-22 CN disclosed
CN-112979938-A Aliphatic polycarbonates for polyurethanes 沙特阿美技术公司 2021-06-18 CN disclosed
CN-110791246-A Adhesive composition and method 沙特阿美技术公司 2020-02-14 CN disclosed
EP-2332998-A1 Solvent free aqueous polyurethane dispersions and methods of making and using the same Air Products and Chemicals, Inc. (US) 2011-06-15 EP disclosed
EP-1073696-A1 SOAP GEL BASED GLUE STICK Henkel Kommanditgesellschaft auf Aktien (DE) 2001-02-07 EP disclosed
WO-1999048989-A1 SOAP GEL BASED GLUE STICK HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1999-09-30 WO disclosed