SCHEMBL8618138

SCHEMBL8618138

[CH2]CC(C)(C)CCCC(C)C

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
CYP3A4 P08684 1/20 0.44
ALOX15 P16050 1/20 0.44
KMT2A Q03164 1/20 0.44
LMNA P02545 1/20 0.36
BLM P54132 1/20 0.31
PTPN2 P17706 1/20 0.30
PTPN1 P18031 1/20 0.30
CDC25B P30305 1/20 0.30
FFAR1 O14842 1/20 0.30
CPT2 P23786 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL27894945 0.84 MEN1 (0.33) MEN1CYP3A4ALOX15KMT2A
SCHEMBL8389001 0.81 OPRM1 (0.41) TDP1
SCHEMBL17607437 0.79 MEN1 (0.36) MEN1CYP3A4ALOX15KMT2A
SCHEMBL29036211 0.78 MEN1 (0.47) MEN1CYP3A4ALOX15KMT2ALMNA
SCHEMBL29084500 0.78 TSHR (0.39) MEN1CYP3A4ALOX15KMT2ALMNA
SCHEMBL28921912 0.78
SCHEMBL3998104 0.77 MEN1 (0.41) MEN1CYP3A4ALOX15KMT2ALMNA
SCHEMBL1298190 0.77 MEN1 (0.41) MEN1CYP3A4ALOX15KMT2ALMNA
SCHEMBL9369077 0.76 MEN1 (0.38) MEN1CYP3A4ALOX15KMT2ALMNA
SCHEMBL21989948 0.75 MEN1 (0.44) MEN1CYP3A4ALOX15KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0623118-B1 CARBAMATE DERIVATIVES AND THEIR USE IN MEDICINE GLAXO WELLCOME SPA (IT) 1998-05-13 EP claimed
US-5486514-A GASTRIN, CHOLECYSTOKININ RECEPTOR ANTAGONISTS GLAXO SPA (IT) 1996-01-23 US claimed
EP-0623118-A1 CARBAMATE DERIVATIVES AND THEIR USE IN MEDICINE GLAXO S.p.A. (IT) 1994-11-09 EP claimed
WO-1993014075-A1 CARBAMATE DERIVATIVES AND THEIR USE IN MEDICINE GLAXO SPA (IT) 1993-07-22 WO claimed
EP-0623118-B1 CARBAMATE DERIVATIVES AND THEIR USE IN MEDICINE GLAXO WELLCOME SPA (IT) 1998-05-13 EP disclosed
US-5486514-A GASTRIN, CHOLECYSTOKININ RECEPTOR ANTAGONISTS GLAXO SPA (IT) 1996-01-23 US disclosed
EP-0623118-A1 CARBAMATE DERIVATIVES AND THEIR USE IN MEDICINE GLAXO S.p.A. (IT) 1994-11-09 EP disclosed
WO-1993014075-A1 CARBAMATE DERIVATIVES AND THEIR USE IN MEDICINE GLAXO SPA (IT) 1993-07-22 WO disclosed