SCHEMBL6847144

SCHEMBL6847144

CCN1C(=O)c2c(Br)c(Br)c(Br)c(Br)c2C1=O.O=C1NC(=O)c2c(Br)c(Br)c(Br)c(Br)c21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1B1 Q16678 4/20 0.36
CA1 P00915 3/20 0.35
CA2 P00918 3/20 0.35
CA7 P43166 3/20 0.35
CA9 Q16790 3/20 0.35
CA12 O43570 2/20 0.35
F2 P00734 1/20 0.34
ELANE P08246 1/20 0.34
CTSG P08311 1/20 0.34
CTRC Q99895 1/20 0.34
ALDH1A1 P00352 3/20 0.33
HSD17B10 Q99714 2/20 0.33
CA4 P22748 2/20 0.33
MAPK1 P28482 1/20 0.32
HIPK2 Q9H2X6 1/20 0.32
MAPT P10636 2/20 0.31
GMNN O75496 1/20 0.31
LMNA P02545 1/20 0.31
THPO P40225 1/20 0.31
BLM P54132 1/20 0.31

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
SCHEMBL3692053 0.88 F2 (0.43) CYP1B1CA1CA2CA7CA9
SCHEMBL19239504 0.77 CYP1B1 (0.45) CYP1B1CA1CA2CA7CA9
Ethane SCHEMBL442578 0.76 CA1 (0.42) CA1CA2CA7CA9CA4
SCHEMBL29470022 0.76 CA1 (0.46) CA1CA2CA7CA9CA4
SCHEMBL465112 0.76 CA1 (0.46) CA1CA2CA7CA9CA4
Potassium SCHEMBL11801578 0.73 CA1 (0.43) CA1CA2CA7CA9CA4
SCHEMBL11801576 0.73 CA1 (0.43) CA1CA2CA7CA9CA4
Ethylene SCHEMBL94243 0.71 CA1 (0.42) CA1CA2CA7CA9CA4
SCHEMBL10933086 0.71 CA9 (0.44) CYP1B1CA1CA2CA7CA9
SCHEMBL17682019 0.71 CYP1B1 (0.41) CYP1B1CA1CA2CA7CA9

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-0111378-B1 FLAME AND DRIPPING EMBER RETARDANT FLEXIBLE POLYURETHANE FOAMS STAUFFER CHEMICAL COMPANY (US) 1987-07-29 EP claimed
EP-1072883-B1 Method for identification of plastic materials by optical measurements SONY INT EUROPE GMBH (DE) 2004-12-08 EP disclosed
US-6555822-B1 Method for identification of plastic materials by optical measurements SONY INTERNATIONAL (EUROPE) GMBH (DE) 2003-04-29 US disclosed
EP-1072883-A1 Method for identification of plastic materials by optical measurements Sony International (Europe) GmbH (DE) 2001-01-31 EP disclosed