SCHEMBL9487362

SCHEMBL9487362

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

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 4/20 0.46
TET2 Q6N021 3/20 0.44
KDM4A O75164 2/20 0.44
KDM4C Q9H3R0 2/20 0.44
KDM2A Q9Y2K7 2/20 0.44
TET3 O43151 1/20 0.44
LMNA P02545 3/20 0.43
MAPT P10636 2/20 0.43
CYP2D6 P10635 1/20 0.43
NFKB1 P19838 1/20 0.43
CYP1A2 P05177 2/20 0.42
GABRP O00591 2/20 0.42
GABRD O14764 2/20 0.42
GABRA1 P14867 2/20 0.42
GABRB1 P18505 2/20 0.42
GABRG2 P18507 2/20 0.42
GABRB3 P28472 2/20 0.42
GABRA5 P31644 2/20 0.42
GABRA3 P34903 2/20 0.42
GABRA2 P47869 2/20 0.42

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
SCHEMBL27685208 0.85 LMNA (0.46) FOLH1LMNANFKB1CYP1A2GABRP
SCHEMBL9859225 0.81 LMNA (0.52) LMNAMAPTCYP2D6NFKB1CYP1A2
Ethylene SCHEMBL29091062 0.81 LMNA (0.42) FOLH1LMNANFKB1CYP1A2GABRP
SCHEMBL29069484 0.79 TET2 (0.44) FOLH1TET2KDM4AKDM4CKDM2A
SCHEMBL29011277 0.78 FOLH1 (0.46) FOLH1TET2KDM4AKDM4CKDM2A
SCHEMBL29011276 0.78 FOLH1 (0.46) FOLH1TET2KDM4AKDM4CKDM2A
SCHEMBL2146570 0.78
SCHEMBL8012030 0.77
SCHEMBL14486586 0.77
SCHEMBL27850966 0.77 PMP22 (0.44) LMNAMAPTCYP3A4TSHRHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0526575-A1 EPOXY RESIN SYSTEMS MODIFIED WITH LOW VISCOSITY STATISTICAL MONOFUNCTIONAL REACTIVE POLYMERS THE B.F. GOODRICH COMPANY (US) 1993-02-10 EP claimed
WO-1991017213-A1 EPOXY RESIN SYSTEMS MODIFIED WITH LOW VISCOSITY STATISTICAL MONOFUNCTIONAL REACTIVE POLYMERS THE B.F. GOODRICH COMPANY (US) 1991-11-14 WO claimed