SCHEMBL3383963

SCHEMBL3383963

CC(C#N)CCCC(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.43
LMNA P02545 2/20 0.42
SLC22A6 Q4U2R8 2/20 0.42
GABRP O00591 2/20 0.41
GABRD O14764 2/20 0.41
GABRA1 P14867 2/20 0.41
GABRB1 P18505 2/20 0.41
GABRG2 P18507 2/20 0.41
GABRB3 P28472 2/20 0.41
GABRA5 P31644 2/20 0.41
GABRA3 P34903 2/20 0.41
GABRA2 P47869 2/20 0.41
GABRB2 P47870 2/20 0.41
GABRA4 P48169 2/20 0.41
GABRE P78334 2/20 0.41
GABRA6 Q16445 2/20 0.41
GABRG1 Q8N1C3 2/20 0.41
GABRG3 Q99928 2/20 0.41
GABRQ Q9UN88 2/20 0.41
CYP1A2 P05177 1/20 0.41

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
SCHEMBL7930124 0.92 FFAR4 (0.48) TSHRLMNASLC22A6GSTK1NFKB1
Water SCHEMBL28240439 0.86 GABRP (0.50) TSHRLMNAGABRPGABRDGABRA1
SCHEMBL35490 0.86
Ammonia Solution, Strong SCHEMBL1024331 0.84 GABRP (0.48) TSHRLMNAGABRPGABRDGABRA1
Ammonia Solution, Strong SCHEMBL28217929 0.84 GABRP (0.48) TSHRLMNAGABRPGABRDGABRA1
SCHEMBL5050240 0.84 GABRP (0.48) TSHRLMNAGABRPGABRDGABRA1
Hydrochloric Acid SCHEMBL27835689 0.84 GABRP (0.48) TSHRLMNAGABRPGABRDGABRA1
SCHEMBL30725511 0.84 GABRP (0.48) TSHRLMNAGABRPGABRDGABRA1
Hydrochloric Acid SCHEMBL7043007 0.84 GABRP (0.48) TSHRLMNAGABRPGABRDGABRA1
SCHEMBL28018620 0.84 GABRP (0.48) TSHRLMNAGABRPGABRDGABRA1

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1851196-B1 LACTAM PRODUCTION METHOD RHODIA CHIMIE SA (FR) 2010-12-01 EP claimed
EP-1851196-A1 LACTAM PRODUCTION METHOD RHODIA CHIMIE (FR) 2007-11-07 EP claimed
WO-2006090044-A1 LACTAM PRODUCTION METHOD RHODIA CHIMIE (FR) 2006-08-31 WO claimed
CN-112770713-B Incorporation of chitosan into microcapsule walls 恩盖普有限公司 2024-05-28 CN disclosed
CN-112770713-A Incorporation of chitosan into microcapsule walls 恩盖普有限公司 2021-05-07 CN disclosed
EP-3568208-A1 PREPARATIONS COMPRISING PARTICULATE POLYQUATERNIUM-6 POLYMERS Beiersdorf AG (DE) 2019-11-20 EP disclosed
EP-1851196-B1 LACTAM PRODUCTION METHOD RHODIA CHIMIE SA (FR) 2010-12-01 EP disclosed
EP-1851196-A1 LACTAM PRODUCTION METHOD RHODIA CHIMIE (FR) 2007-11-07 EP disclosed
WO-2006090044-A1 LACTAM PRODUCTION METHOD RHODIA CHIMIE (FR) 2006-08-31 WO disclosed
EP-1335904-B1 PRODUCTION OF ALKYL 6-AMINOCAPROATE INVISTA TECH SARL (US) 2006-03-08 EP disclosed
EP-1335904-A2 PRODUCTION OF ALKYL 6-AMINOCAPROATE INVISTA Technologies S.à.r.l. (US) 2003-08-20 EP disclosed
US-5183872-A Reverse phase suspension polymerization; dewatering, crosslinking STARCHEM GMBH (DE) 1993-02-02 US disclosed
US-4950778-A REACTING PENTENENITRILE, CARBON MONOXIDE AND WATER OR ALCOHOL IN PRESENCE OF COBALT-CONTAINING CARBONYLATION CATALYST E. I. DU PONT DE NEMOURS & COMPANY (US) 1990-08-21 US disclosed
EP-0377838-A1 Manufacture of 5-cyanovaleric acid and its esters E.I. DU PONT DE NEMOURS AND COMPANY (US) 1990-07-18 EP disclosed
EP-0373579-A1 Manufacture of 5-cyanovaleric acid and its esters using cyclic cosolvents E.I. DU PONT DE NEMOURS AND COMPANY (US) 1990-06-20 EP disclosed
US-4933483-A Manufacture of 5-cyanovaleric acid and its esters E. I. DU PONT DE NEMOURS AND COMPANY (US) 1990-06-12 US disclosed
EP-0023751-B1 PROCESS FOR PRODUCING FIVE, SIX OR SEVEN MEMBERED SATURATED NITROGEN CONTAINING HETEROCYCLIC COMPOUNDS THE STANDARD OIL COMPANY (US) 1983-12-14 EP disclosed
US-4301090-A USING A POLYAMINE LIGAND PROMOTER TO FORM ESTERS, ALDEHYDES, AND AMIDES STANDARD OIL COMPANY 1981-11-17 US disclosed
US-4250093-A HYDROGENATION-CYCLIZATION OF B-, G-, OR D-CYANO ESTERS USING A RUTHENIUM OR IRON METAL CATALYST THE STANDARD OIL COMPANY (OHIO) 1981-02-10 US disclosed
US-4235744-A Carbonylation of olefinically unsaturated compounds STANDARD OIL COMPANY (OHIO) (US) 1980-11-25 US disclosed