SCHEMBL6295487

SCHEMBL6295487

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

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
PTPN1 P18031 2/20 0.38
CA1 P00915 2/20 0.35
BLM P54132 1/20 0.33
KDM1A O60341 1/20 0.33
KDM4C Q9H3R0 2/20 0.31
KDM4A O75164 1/20 0.31
PHF8 Q9UPP1 1/20 0.31
KDM2A Q9Y2K7 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
SCHEMBL29065774 0.87 CES1 (0.35) LMNAPTPN1CA1BLMKDM1A
SCHEMBL6626453 0.87 LMNA (0.35) LMNAPTPN1CA1BLMKDM1A
SCHEMBL926657 0.82 CA1 (0.43) LMNACA1
SCHEMBL16244845 0.79 FFAR4 (0.42) LMNA
SCHEMBL988399 0.76 PTPN1 (0.41) LMNAPTPN1CA1BLMKDM1A
SCHEMBL1626506 0.74 LMNA (0.48) LMNAPTPN1CA1BLMKDM4C
SCHEMBL11594555 0.74 LMNA (0.48) LMNAPTPN1CA1BLMKDM4C
SCHEMBL128911 0.74 TDP1 (0.43) LMNAPTPN1CA1BLMKDM1A
SCHEMBL11692425 0.74 LMNA (0.36) LMNAPTPN1CA1BLMKDM1A
SCHEMBL8579213 0.72 CA1 (0.40) CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6849743-B2 Synthesis of clasto-lactacystin β-lactone and analogs thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2005-02-01 US disclosed
US-5436231-A HYPERTENSIVE AGENTS SANKYO COMPANY, LIMITED (JP) 1995-07-25 US disclosed