SCHEMBL6808029

SCHEMBL6808029

C=C(C)C(=O)NCN(C)CC

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 1/20 0.33
THRB P10828 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL4641176 0.84 KDM5A (0.33) TGFBR1
SCHEMBL888113 0.81 TGFBR1 (0.34) TGFBR1THRBALDH1A1
SCHEMBL22173 0.80 TGFBR1 (0.36) TGFBR1ALDH1A1
SCHEMBL11344769 0.80 TGFBR1 (0.35) TGFBR1
SCHEMBL109244 0.80 KDM5A (0.34) TGFBR1ALDH1A1
SCHEMBL19605885 0.80
Hydrochloric Acid SCHEMBL11184249 0.78 TGFBR1 (0.35) TGFBR1ALDH1A1
SCHEMBL21181694 0.78
SCHEMBL111983 0.77 KDM4E (0.41) ALDH1A1
N,N-Dimethylethanaminium SCHEMBL446422 0.77 TGFBR1 (0.38) TGFBR1THRBALDH1A1

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
EP-0864592-B1 DIENE RUBBER ZEON CORP (JP) 2004-09-22 EP disclosed
EP-0882738-B1 DIENE RUBBER, PROCESS FOR PRODUCING THE RUBBER AND RUBBER COMPOSITION CONTAINING THE SAME ZEON CORP (JP) 2002-11-20 EP disclosed
US-6211321-B1 CONTAINING A TERTIARY AMINO-CONTAINING VINYL MONOMER AND A HALOGEN CONTAINING VONYL MONOMER NIPPON ZEON CO., LTD. (JP) 2001-04-03 US disclosed
US-6147178-A RUBBER COMPRISING DIENE-VINYL AROMATIC COPOLYMER BEARING QUATERNARY AMMONIUM GROUPS; TENSILE STRENGTH, WEAR RESISTANCE, HEAT RESISTANCE, IMPROVED AFFINITY FOR SILICA REINFORCEMENT NIPPON ZEON CO., LTD. (JP) 2000-11-14 US disclosed
EP-0882738-A1 DIENE RUBBER, PROCESS FOR PRODUCING THE RUBBER AND RUBBER COMPOSITION CONTAINING THE SAME NIPPON ZEON CO., LTD. (JP) 1998-12-09 EP disclosed