SCHEMBL9823939

SCHEMBL9823939

C=CCCC1(C)CC(=O)NC1=O

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
CYP2C19 P33261 1/20 0.36
CYP19A1 P11511 4/20 0.33

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
SCHEMBL9011515 0.78 TSHR (0.69) TSHRNPSR1KDM4ELMNACYP2C19
SCHEMBL1566072 0.78 TSHR (0.69) TSHRNPSR1KDM4ELMNACYP2C19
SCHEMBL18497847 0.75 TSHR (0.65) TSHRNPSR1KDM4ELMNACYP2C19
SCHEMBL9824399 0.73 TSHR (0.57) TSHRNPSR1KDM4ELMNACYP2C19
SCHEMBL9824431 0.73 TSHR (0.57) TSHRNPSR1KDM4ELMNACYP2C19
Ethosuximide SCHEMBL34212 0.73 TSHR (1.00) TSHRNPSR1KDM4ELMNACYP2C19
Ethosuximide SCHEMBL20980115 0.73 TSHR (1.00) TSHRNPSR1KDM4ELMNACYP2C19
Ethosuximide SCHEMBL118395 0.73 TSHR (1.00) TSHRNPSR1KDM4ELMNACYP2C19
Ethosuximide SCHEMBL4654769 0.73 TSHR (1.00) TSHRNPSR1KDM4ELMNACYP2C19
SCHEMBL9824805 0.72 TSHR (0.55) TSHRNPSR1KDM4ELMNACYP2C19

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-0199963-B1 ETHOSUXIMIDE ASSAY TRACERS, IMMUNOGENS AND ANTIBODIES ABBOTT LABORATORIES (US) 1991-10-23 EP disclosed
EP-0199963-A1 Ethosuximide assay tracers, immunogens and antibodies ABBOTT LABORATORIES (US) 1986-11-05 EP disclosed