SCHEMBL2124764

SCHEMBL2124764

CC(C)CCC[CH]CC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35
MEN1 O00255 1/20 0.34
CYP3A4 P08684 1/20 0.34
ALOX15 P16050 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL8618134 0.85
SCHEMBL1192124 0.79 LMNA (0.33) LMNA
SCHEMBL28868791 0.79 LMNA (0.45) LMNAMEN1CYP3A4ALOX15KMT2A
SCHEMBL17135334 0.74 LMNA (0.34) LMNAMEN1CYP3A4ALOX15KMT2A
SCHEMBL971387 0.74 LMNA (0.48) LMNAMEN1CYP3A4ALOX15KMT2A
SCHEMBL423846 0.74 LMNA (0.41) LMNAMEN1CYP3A4ALOX15KMT2A
SCHEMBL2532944 0.72
SCHEMBL286602 0.72 LMNA (0.46) LMNA
SCHEMBL2320588 0.72 TSHR (0.39) LMNA
SCHEMBL14775581 0.72 LMNA (0.39) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2443087-A1 DISUBSTITUTED-AMINODIFLUOROSULFINIUM SALTS, PROCESS FOR PREPARING SAME AND METHOD OF USE AS DEOXOFLUORINATION REAGENTS Omegachem Inc. (CA) 2012-04-25 EP disclosed
WO-2010145037-A1 DISUBSTITUTED-AMINODIFLUOROSULFINIUM SALTS, PROCESS FOR PREPARING SAME AND METHOD OF USE AS DEOXOFLUORINATION REAGENTS OMEGACHEM INC. (CA) 2010-12-23 WO disclosed
US-3948946-A Cyclic acetals and mercaptals SANDOZ LTD., (SANDOZ AG) (CH) 1976-04-06 US disclosed