SCHEMBL9529709

SCHEMBL9529709

CC(C)([SiH2]OCCCCCc1ccccc1/C=C/C=C/C=O)C(c1ccccc1)c1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 2/20 0.32
CCND1 P24385 2/20 0.32
CCNB2 O95067 1/20 0.30
CDK1 P06493 1/20 0.30
CCNB1 P14635 1/20 0.30
CCNB3 Q8WWL7 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
SCHEMBL9524683 0.87
SCHEMBL9526202 0.83
SCHEMBL9526958 0.83 PTGER4 (0.30)
SCHEMBL9525864 0.81
SCHEMBL9525131 0.77 ELANE (0.33)
SCHEMBL9526101 0.74
SCHEMBL9529713 0.74 CDK4 (0.34) CDK4CCND1CCNB2CDK1CCNB1
SCHEMBL702652 0.69 LTA4H (0.39)
SCHEMBL2941319 0.67 LIPG (0.47) CDK4CCND1CCNB2CDK1CCNB1
SCHEMBL152797 0.67 LIPG (0.47) CDK4CCND1CCNB2CDK1CCNB1

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-0419610-B1 NEW LEUKOTRIENE B4 DERIVATIVES, PROCESS FOR PRODUCING THEM AND THEIR USE AS DRUGS SCHERING AKTIENGESELLSCHAFT (DE) 1993-09-15 EP disclosed
EP-0419610-A1 NEW LEUKOTRIENE B4 DERIVATIVES, PROCESS FOR PRODUCING THEM AND THEIR USE AS DRUGS. SCHERING AG (DE) 1991-04-03 EP disclosed
WO-1990011271-A1 NEW LEUKOTRIENE B4 DERIVATIVES, PROCESS FOR PRODUCING THEM AND THEIR USE AS DRUGS SCHERING AKTIENGESELLSCHAFT BERLIN UND BERGKAMEN (DE) 1990-10-04 WO disclosed