SCHEMBL5479797

SCHEMBL5479797

C=C(CC1CNCCN1)C(=O)OCC

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.34
OPRM1 P35372 1/20 0.32
MAPT P10636 1/20 0.32
PKM P14618 1/20 0.32
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 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
SCHEMBL465152 0.87 ALDH1A1 (0.40) ALDH1A1TSHRMAPTCYP2D6CYP2C19
SCHEMBL172322 0.81 MGAM (0.38) ALDH1A1MAPTPKM
SCHEMBL123309 0.81 MGAM (0.38) ALDH1A1MAPTPKM
SCHEMBL17784662 0.79 ALDH1A1 (0.39) ALDH1A1TSHROPRM1MAPTCYP2D6
SCHEMBL31514971 0.79 FDPS (0.40) ALDH1A1TSHROPRM1MAPTCYP2D6
SCHEMBL5478635 0.74 SLC6A2 (0.40) ALDH1A1TSHR
SCHEMBL2915906 0.72 POLB (0.37) ALDH1A1MAPTPKM
SCHEMBL27801248 0.72 ALDH1A1 (0.38) ALDH1A1TSHRMAPTPKM
SCHEMBL4629845 0.71 MAPT (0.37) ALDH1A1TSHRMAPTPKM
SCHEMBL28013177 0.71 SLC6A1 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7214247-B2 Polymers for laundry cleaning compositions UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. (US) 2007-05-08 US claimed
EP-1456261-A2 POLYMERS FOR LAUNDRY CLEANING COMPOSITIONS Unilever Plc (GB) 2004-09-15 EP claimed
US-20030130160-A1 Polymers for laundry cleaning compositions UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2003-07-10 US claimed
WO-2003054044-A2 POLYMERS FOR LAUNDRY CLEANING COMPOSITIONS UNILEVER PLC (GB) 2003-07-03 WO claimed
US-7214247-B2 Polymers for laundry cleaning compositions UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. (US) 2007-05-08 US disclosed
EP-1456261-A2 POLYMERS FOR LAUNDRY CLEANING COMPOSITIONS Unilever Plc (GB) 2004-09-15 EP disclosed
US-20030130160-A1 Polymers for laundry cleaning compositions UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2003-07-10 US disclosed
WO-2003054044-A2 POLYMERS FOR LAUNDRY CLEANING COMPOSITIONS UNILEVER PLC (GB) 2003-07-03 WO disclosed