SCHEMBL6677112

SCHEMBL6677112

CCOC(=O)c1cccc(C(=O)CN2CCCCC2)c1N

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.49
MAPT P10636 1/20 0.49
HSD17B10 Q99714 2/20 0.48
TSHR P16473 1/20 0.46
KDM4E B2RXH2 3/20 0.46
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
GLA P06280 1/20 0.44
MAOB P27338 1/20 0.43
HPGD P15428 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
POLB P06746 1/20 0.43
GAA P10253 1/20 0.43
CASP1 P29466 1/20 0.43
KLK7 P49862 1/20 0.43
CASP7 P55210 1/20 0.43
KMT2A Q03164 2/20 0.42

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
SCHEMBL27424975 0.80 TSHR (0.70) ALDH1A1MAPTHSD17B10TSHRKDM4E
SCHEMBL8483046 0.79 ALDH1A1 (0.54) ALDH1A1MAPTKDM4ENPC1GLA
SCHEMBL28237362 0.78 ALDH1A1 (0.58) ALDH1A1MAPTHSD17B10TSHRKDM4E
SCHEMBL3122205 0.78 ALPL (0.50) ALDH1A1HSD17B10KDM4ERAB9AGLA
SCHEMBL28379040 0.76 ALDH1A1 (0.57) ALDH1A1MAPTHSD17B10TSHRKDM4E
SCHEMBL27424971 0.74 HSD17B10 (0.62) ALDH1A1MAPTHSD17B10TSHRKDM4E
SCHEMBL13816768 0.74 ALDH1A1 (0.62) ALDH1A1MAPTHSD17B10TSHRKDM4E
Ethyl Benzoate SCHEMBL27872077 0.74 ALDH1A1 (0.50) ALDH1A1MAPTTSHRKDM4ENPC1
SCHEMBL6677108 0.73 KDM4E (0.45) ALDH1A1MAPTKDM4ENPC1RAB9A
SCHEMBL663035 0.73 ALDH1A1 (0.67) ALDH1A1HSD17B10TSHRKDM4EHPGD

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
EP-1188435-B1 Intraoral adhesive preparation NITTO DENKO CORP (JP) 2004-10-27 EP disclosed
US-6676960-B2 NONWOVEN FABRIC SUPPORT MADE OF SPLIT TYPE CONJUGATED FIBERS WITH A TRIANGULAR CROSS-SECTION, AND AN ADHESIVE PLASTER LAYER CONTAINING A DRUG NITTO DENKO CORPORATION (JP) 2004-01-13 US disclosed
US-20020071860-A1 Intraoral adhesive preparation NITTO DENKO CORPORATION (JP) 2002-06-13 US disclosed
US-6387392-B1 COMPRISING A PRESSURE-SENSITIVE ADHESIVE LAYER CONTAINING A DRUG ON A CLOTH WHICH PREVENTS THE DILUTION OF DRUG BY SALIVA NITTO DENKO CORPORATION (JP) 2002-05-14 US disclosed
US-20020051753-A1 INTRAORAL ADHESIVE PREPARATION NITTO DENKO CORPORATION (JP) 2002-05-02 US disclosed
EP-1188435-A1 Intraoral adhesive preparation NITTO DENKO CORPORATION (JP) 2002-03-20 EP disclosed
EP-1181931-A2 Intraoral adhesive preparation NITTO DENKO CORPORATION (JP) 2002-02-27 EP disclosed