SCHEMBL9543028

SCHEMBL9543028

CC1(CCBr)CCC(=O)C1

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
CYP2C19 P33261 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
SCHEMBL7752623 0.76
SCHEMBL16193280 0.74 CNR2 (0.32)
SCHEMBL17582527 0.74 CNR2 (0.32)
SCHEMBL11810423 0.69 ALDH1A1 (0.35) LMNACYP2C19
SCHEMBL20204315 0.69 KDM4E (0.33) KDM4ELMNACYP2C19
SCHEMBL23270100 0.69
SCHEMBL16193265 0.68 FAAH (0.41)
SCHEMBL17582520 0.68 FAAH (0.41)
SCHEMBL18434036 0.67 KDM4E (0.33) KDM4ELMNACYP2C19
SCHEMBL16193282 0.67

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
WO-1993007119-A1 NOVEL ANTIMALARIAL PEROXIDES AND PROCESSES FOR THEIR PRODUCTION AND USE BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) 1993-04-15 WO disclosed