SCHEMBL9953966

SCHEMBL9953966

C[CH]C(C)CCCC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
CYP3A4 P08684 1/20 0.31
ALOX15 P16050 1/20 0.31
KMT2A Q03164 1/20 0.31
RIPK1 Q13546 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
SCHEMBL27764431 0.84 RIPK1 (0.37) RIPK1
SCHEMBL11762792 0.78 TP53 (0.34) MEN1CYP3A4ALOX15KMT2A
SCHEMBL1171382 0.78 ALDH1A1 (0.39) CYP3A4
SCHEMBL4724323 0.75
SCHEMBL598576 0.73 MEN1 (0.45) MEN1CYP3A4ALOX15KMT2ARIPK1
SCHEMBL25927335 0.70 RIPK1 (0.37) MEN1CYP3A4ALOX15KMT2ARIPK1
SCHEMBL25927332 0.70 RIPK1 (0.37) MEN1CYP3A4ALOX15KMT2ARIPK1
SCHEMBL56129 0.70
SCHEMBL1658860 0.70 RIPK1 (0.37) MEN1CYP3A4ALOX15KMT2ARIPK1
SCHEMBL2913692 0.70 LMNA (0.48) MEN1CYP3A4ALOX15KMT2A

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-2012087243-A1 NEW P-TYPE LOW BANDGAP POLYMERS AND THEIR USE AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2012-06-28 WO claimed