SCHEMBL9683654

SCHEMBL9683654

CCN(CCO)C(=O)N(CC)CCO

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
ALDH2 P05091 2/20 0.50
LMNA P02545 2/20 0.40
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39
MMP3 P08254 1/20 0.39
MMP8 P22894 1/20 0.39
CA12 O43570 5/20 0.38
CA9 Q16790 5/20 0.38
CA1 P00915 4/20 0.38
MAPT P10636 1/20 0.36
CA2 P00918 3/20 0.36
MLYCD O95822 1/20 0.34
KDM4E B2RXH2 1/20 0.33
GLA P06280 1/20 0.33
POLB P06746 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HTR1A P08908 1/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL19171663 0.87 ALDH1A1 (0.45) ALDH1A1ALDH2LMNAMMP1MMP2
SCHEMBL193410 0.82 CA12 (0.43) ALDH1A1ALDH2CA12CA9CA1
SCHEMBL871699 0.81
SCHEMBL8637059 0.81
SCHEMBL741280 0.79
SCHEMBL28912905 0.79 ALDH1A1 (0.46) ALDH1A1ALDH2LMNAMMP1MMP2
SCHEMBL19945648 0.79
SCHEMBL2830770 0.79
SCHEMBL134968 0.79 ALDH1A1 (0.46) ALDH1A1ALDH2LMNAMMP1MMP2
SCHEMBL210439 0.78 LMNA (0.52) ALDH1A1ALDH2LMNAMMP1MMP2

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
US-5158808-A Method of coating with a water borne composition UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1992-10-27 US disclosed
US-5039759-A Water borne high solids coating compositions TECHNOLOGY CORPORATION UNITED CARBIDE CHEMICALS AND PLASTICS (US) 1991-08-13 US disclosed
EP-0212380-B1 AQUEOUS HIGH SOLIDS COATING COMPOSITIONS UNION CARBIDE CORPORATION (US) 1990-09-19 EP disclosed
EP-0212380-A2 Aqueous high solids coating compositions UNION CARBIDE CORPORATION (US) 1987-03-04 EP disclosed
EP-0211359-A1 High solids coating compositions UNION CARBIDE CORPORATION (US) 1987-02-25 EP disclosed