SCHEMBL10792995

SCHEMBL10792995

CCCCN(CCC)N=O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.46
CA12 O43570 4/20 0.39
CA9 Q16790 4/20 0.39
CA1 P00915 4/20 0.39
TDP1 Q9NUW8 1/20 0.32
CA2 P00918 2/20 0.32
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP3 P08254 1/20 0.32
MMP8 P22894 1/20 0.32
DNM1 Q05193 1/20 0.31
ALDH1A1 P00352 1/20 0.30
ALDH2 P05091 1/20 0.30
LMNA P02545 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
SCHEMBL606730 0.95 TSHR (0.50) TSHRCA12CA9CA1TDP1
SCHEMBL23477341 0.90 TSHR (0.46) TSHRCA12CA9CA1TDP1
SCHEMBL606823 0.89
SCHEMBL896509 0.86 TSHR (0.48) TSHRCA12CA9CA1CA2
SCHEMBL31423402 0.86 TSHR (0.53) TSHRCA12CA9CA1CA2
SCHEMBL3341604 0.84
SCHEMBL10793051 0.84 DNM1 (0.48) TSHRCA12CA9CA1CA2
SCHEMBL11554162 0.84 DNM1 (0.48) TSHRCA12CA9CA1CA2
SCHEMBL11416179 0.84 DNM1 (0.48) TSHRCA12CA9CA1CA2
SCHEMBL4732004 0.83 CA12 (0.40) TSHRCA12CA9CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140263096-A1 PROCESS FOR CHEMICAL DESTRUCTION OF COMPOUNDS FROM AMINE-BASED CARBON CAPTURE SINVENT AS (NO) 2014-09-18 US disclosed
EP-2720779-A1 PROCESS FOR CHEMICAL DESTRUCTION OF COMPOUNDS FROM AMINE-BASED CARBON CAPTURE Sinvent AS (NO) 2014-04-23 EP disclosed
WO-2012171973-A1 PROCESS FOR CHEMICAL DESTRUCTION OF COMPOUNDS FROM AMINE-BASED CARBON CAPTURE SINVENT AS (NO) 2012-12-20 WO disclosed
EP-2535100-A1 Process for chemical destruction of compounds from amine-based carbon capture Sinvent AS (NO) 2012-12-19 EP disclosed
US-4675445-A Process for elimination N-nitrosamines from N-nitrosamine-containing compositions BASF CORPORATION (US) 1987-06-23 US disclosed
US-4166169-A POLYMERIZABLE POLYACRYLIC ESTERS FELT PRODUCTS MFG. CO. (US) 1979-08-28 US disclosed
US-4090997-A High-strength anaerobic sealant composition and method of preparation FELT PRODUCTS MFG. CO. (US) 1978-05-23 US disclosed