SCHEMBL8601452

SCHEMBL8601452

Cc1[c]ccc(C(C)C)c1Cl

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB1 P18505 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
SCHEMBL9245578 0.78 GABRA1 (0.31) GABRA1GABRB1
SCHEMBL28137208 0.73
SCHEMBL9243350 0.72
SCHEMBL180124 0.72
SCHEMBL27317473 0.70 GABRA1 (0.42) LMNAGABRA1GABRB1
SCHEMBL3236614 0.70 GABRA1 (0.31) GABRA1GABRB1
SCHEMBL9648530 0.69 KCNH2 (0.33)
SCHEMBL6013934 0.68 GABRA1 (0.41) LMNAGABRA1GABRB1
SCHEMBL2344895 0.68
SCHEMBL28233265 0.68

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5767286-A REACTING A TETRAZOLINONE WITH A CARBAMOYL CHLORIDE IN THE PRESENCE OF 4-DIMETHYLAMINOPYRIDINE NIHON BAYER AGROCHEM K. K. (JP) 1998-06-16 US disclosed