SCHEMBL6903674

SCHEMBL6903674

CCc1ccccc1CC.COCNC(C)=O

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 7/20 0.50
MTNR1B P49286 7/20 0.50
L3MBTL1 Q9Y468 1/20 0.41
TSHR P16473 1/20 0.41
ALDH1A1 P00352 2/20 0.40
LMNA P02545 1/20 0.40
SETDB1 Q15047 1/20 0.40

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
SCHEMBL1832048 0.79
SCHEMBL14651452 0.79 SETDB1 (0.54) MTNR1AMTNR1BALDH1A1SETDB1
SCHEMBL9861981 0.73 SETDB1 (0.49) MTNR1AMTNR1BALDH1A1SETDB1
Acetic Acid SCHEMBL1724578 0.73 GABRA1 (0.52) L3MBTL1TSHRALDH1A1
Methoxymethane SCHEMBL27728603 0.72 GABRA1 (0.50) L3MBTL1TSHR
SCHEMBL18802064 0.72 CYP4F2 (0.57) MTNR1AMTNR1BTSHRALDH1A1LMNA
SCHEMBL14204990 0.71 SETDB1 (0.59) MTNR1AMTNR1BALDH1A1SETDB1
SCHEMBL11972779 0.71 KDM4E (0.49) L3MBTL1TSHRALDH1A1LMNA
SCHEMBL3355192 0.71 GABRA1 (0.50) ALDH1A1
Acetamide SCHEMBL27416699 0.71 GABRA1 (0.50) L3MBTL1TSHRALDH1A1LMNA

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-1024691-A4 SOLUBLE POLYMER BASED MATRIX FOR CHEMICALLY ACTIVE WATER INSOLUBLE COMPONENTS ISP INVESTMENTS INC (US) 2004-08-18 EP disclosed
EP-1024691-A1 SOLUBLE POLYMER BASED MATRIX FOR CHEMICALLY ACTIVE WATER INSOLUBLE COMPONENTS ISP INVESTMENTS INC. (US) 2000-08-09 EP disclosed
WO-1998033378-A1 SOLUBLE POLYMER BASED MATRIX FOR CHEMICALLY ACTIVE WATER INSOLUBLE COMPONENTS ISP INVESTMENTS INC. (US) 1998-08-06 WO disclosed
WO-1998006780-A1 STABILIZER ADDITIVE FOR AGCHEMICAL TANK MIX ISP INVESTMENTS INC. (US) 1998-02-19 WO disclosed
EP-0701398-A4 INERT MATRIX COMPOSITION, PREPARATION THEREOF AND MICROEMULSIFIABLE CONCENTRATE ISP INVESTMENTS INC (US) 1998-01-07 EP disclosed
EP-0701398-A1 INERT MATRIX COMPOSITION, PREPARATION THEREOF AND MICROEMULSIFIABLE CONCENTRATE ISP INVESTMENTS INC. (US) 1996-03-20 EP disclosed
WO-1994028711-A1 INERT MATRIX COMPOSITION, PREPARATION THEREOF AND MICROEMULSIFIABLE CONCENTRATE ISP INVESTMENTS INC. (US) 1994-12-22 WO disclosed