SCHEMBL11201978

SCHEMBL11201978

CNC(=O)C(Sc1ccccc1)(Sc1ccccc1)C(=O)NC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
POLB P06746 3/20 0.39
MAPK1 P28482 2/20 0.39
ALDH1A1 P00352 2/20 0.37
HPGD P15428 1/20 0.37
HDAC3 O15379 1/20 0.37
HDAC4 P56524 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC7 Q8WUI4 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC10 Q969S8 1/20 0.37
HDAC11 Q96DB2 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
HDAC9 Q9UKV0 1/20 0.37
HDAC5 Q9UQL6 1/20 0.37
MTNR1A P48039 4/20 0.37
MTNR1B P49286 4/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
FFAR1 O14842 1/20 0.36

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
SCHEMBL11208198 0.79 ALDH1A1 (0.47) LMNAPOLBMAPK1ALDH1A1HPGD
SCHEMBL6405062 0.78 HDAC3 (0.41) LMNAPOLBMAPK1ALDH1A1HPGD
SCHEMBL11208326 0.76 CYP1A2 (0.44) LMNAPOLBALDH1A1HPGDSMN1; SMN2
SCHEMBL11264686 0.73 ALDH1A1 (0.42) LMNAPOLBMAPK1ALDH1A1HPGD
SCHEMBL10523948 0.73 HSD17B10 (0.48) POLBMAPK1ALDH1A1HPGDSMN1; SMN2
SCHEMBL6688633 0.72 MAPT (0.43) LMNAPOLBMAPK1ALDH1A1HPGD
SCHEMBL11211696 0.72 OPRM1 (0.42) ALDH1A1HPGDMTNR1AMTNR1BSMN1; SMN2
SCHEMBL11204292 0.70 ALDH1A1 (0.45) POLBMAPK1ALDH1A1HPGDSMN1; SMN2
SCHEMBL11265491 0.69 FFAR1 (0.38) LMNAALDH1A1HPGDMTNR1AMTNR1B
SCHEMBL11208113 0.69 KCNN4 (0.44) MAPK1ALDH1A1HPGDMTNR1AMTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0029719-B1 VULCANIZABLE RUBBER COMPOSITIONS INHIBITED FROM PREMATURE VULCANIZATION BY METHYLENE THIOETHERS, AND NOVEL METHYLENE THIOETHERS MONSANTO COMPANY (US) 1983-02-16 EP disclosed
US-4342705-A CONTAINING CARBONYL OR CYANO FUNCTIONAL GROUPS, USEFUL AS VULCANIZATION INHIBITORS MONSANTO COMPANY (US) 1982-08-03 US disclosed
EP-0029719-A1 Vulcanizable rubber compositions inhibited from premature vulcanization by methylene thioethers, and novel methylene thioethers MONSANTO COMPANY (US) 1981-06-03 EP disclosed
US-4271050-A Vulcanizable rubber compositions inhibited from premature vulcanization by methylene thioethers MONSANTO COMPANY (US) 1981-06-02 US disclosed