SCHEMBL7535158

SCHEMBL7535158

OC(CCl)COCCOCC(O)CCl

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
CA9 Q16790 1/20 0.41
HSD17B10 Q99714 1/20 0.40
USP2 O75604 1/20 0.37
HTT P42858 1/20 0.35
ALDH1A1 P00352 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
TSHR P16473 1/20 0.33
KDM4E B2RXH2 1/20 0.32
AR P10275 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
LPAR5 Q9H1C0 1/20 0.31
CA7 P43166 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
SCHEMBL9447829 0.97 CA1 (0.39) CA1CA2CA9HSD17B10USP2
SCHEMBL9447834 0.97 CA1 (0.39) CA1CA2CA9HSD17B10USP2
SCHEMBL1332926 0.89
SCHEMBL1332928 0.89
SCHEMBL9440532 0.88 HSD17B10 (0.38) CA1CA2CA9HSD17B10USP2
SCHEMBL17189832 0.88 CA1 (0.33) CA1CA2CA9HSD17B10USP2
SCHEMBL202567 0.88 CA1 (0.45) CA1CA2CA9HSD17B10USP2
SCHEMBL23559507 0.87
SCHEMBL5832062 0.87
SCHEMBL5021528 0.87

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2002038371-A METHOD FOR PREVENTING FIBRILLATION OF CELLULOSE FIBER IPPOSHA OIL IND CO LTD 2002-02-06 JP disclosed
US-5224963-A Improving perspiration fastness BASF AKTIENGESELLSCHAFT (DE) 1993-07-06 US disclosed
US-5015754-A Cationic polyethers for fixing reative and direct dyes used for dyeing and printing cellulose textiles; washfastness BASF AKTIENGESELLSCHAFT (DE) 1991-05-14 US disclosed
EP-0390777-A1 CYCLOCARBONATE COMPOUNDS DAINIPPON INK AND CHEMICALS, INC. (JP) 1990-10-10 EP disclosed
WO-1989000565-A1 CYCLOCARBONATE COMPOUNDS DAINIPPON INK & CHEMICALS, INC. (JP) 1989-01-26 WO disclosed
US-4020271-A SANITARY NAPKINS AND TAMPONS PERSONAL PRODUCTS COMPANY (US) 1977-04-26 US disclosed