SCHEMBL11023866

SCHEMBL11023866

CC1(CN2OC2=O)CCCC1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
CYP2C19 P33261 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
SCHEMBL27774629 0.67 MGLL (0.41) LMNACYP2C19
SCHEMBL6604973 0.65 PIK3CD (0.48) LMNACYP2C19
SCHEMBL7621090 0.64 PIK3CD (0.47) LMNACYP2C19
SCHEMBL6602752 0.62 TSHR (0.35) LMNA
SCHEMBL22969999 0.62 TSHR (0.32)
SCHEMBL14147928 0.61
SCHEMBL18159150 0.61 HTT (0.42) KDM4ELMNA
SCHEMBL10129066 0.61 TSHR (0.38) LMNA
SCHEMBL26614403 0.61 TSHR (0.38) LMNA
SCHEMBL20445550 0.60 CYP2C19 (0.54) KDM4ELMNACYP2C19

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
EP-0160208-A1 3-(2,2-Tetramethylenepropyl)-1,3,5-triazine-2,4-diones BAYER AG (DE) 1985-11-06 EP disclosed