SCHEMBL6533837

SCHEMBL6533837

CCCCCC1C(O[Si](C(C)C)(C(C)C)C(C)C)C(=O)N1C(=O)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.38
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
POLB P06746 1/20 0.34
TPSAB1 Q15661 1/20 0.34
TPSD1 Q9BZJ3 1/20 0.34
TPSG1 Q9NRR2 1/20 0.34
CES2 O00748 2/20 0.34
CES1 P23141 2/20 0.34
PRSS1 P07477 2/20 0.33
CTSG P08311 2/20 0.33
CTRB1 P17538 2/20 0.33
CMA1 P23946 2/20 0.33
CTSK P43235 2/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33

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
SCHEMBL5568919 1.00 FOLH1 (0.38) FOLH1KDM4ELMNAHTTNPSR1
SCHEMBL6980249 0.83 FOLH1 (0.42) FOLH1KDM4ELMNAHTTNPSR1
SCHEMBL6980245 0.83 FOLH1 (0.42) FOLH1KDM4ELMNAHTTNPSR1
SCHEMBL6980243 0.83 FOLH1 (0.42) FOLH1KDM4ELMNAHTTNPSR1
SCHEMBL8746478 0.76 ELANE (0.49) FOLH1MEN1KMT2APOLBELANE
SCHEMBL7776782 0.76 ELANE (0.49) FOLH1MEN1KMT2APOLBELANE
SCHEMBL4168099 0.74 ALDH1A1 (0.38) FOLH1LMNAMEN1KMT2APOLB
SCHEMBL7777570 0.70 ELANE (0.43) KDM4EMEN1KMT2APOLBELANE
SCHEMBL14344821 0.70 POLB (0.37) FOLH1KDM4ELMNAHTTMEN1
SCHEMBL14344945 0.70 POLB (0.37) FOLH1KDM4ELMNAHTTMEN1

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-2005070414-A1 CONFORMATIONALLY CONSTRAINED PACLITAXEL ANALOGS AND THEIR USE AS ANTICANCER AND ANTI-ALZHEIMERS AGENTS VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) 2005-08-04 WO disclosed