SCHEMBL8169355

SCHEMBL8169355

CC1CCC(C)(C)CCC1CCC1CCCCCC1

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.36
SIGMAR1 Q99720 10/20 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
SCHEMBL3835776 0.82 CYP1A2 (0.46) CYP1A2SIGMAR1
SCHEMBL16191039 0.80 CYP1A2 (0.44) CYP1A2SIGMAR1
SCHEMBL10989876 0.78 CYP1A2 (0.43) CYP1A2SIGMAR1
SCHEMBL16191458 0.69 CYP1A2 (0.39) CYP1A2SIGMAR1
SCHEMBL16192422 0.69 CYP1A2 (0.39) CYP1A2SIGMAR1
SCHEMBL16191259 0.68 ACHE (0.32) CYP1A2
SCHEMBL16191127 0.67 CA1 (0.41) CYP1A2
SCHEMBL2573209 0.67 CYP1A2 (0.58) CYP1A2SIGMAR1
SCHEMBL60655 0.67 CYP1A2 (0.58) CYP1A2SIGMAR1
SCHEMBL5617552 0.67 CYP1A2 (0.58) CYP1A2SIGMAR1

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
US-6080769-A Imidazolidin-4-one derivatives useful as anticancer agents PFIZER INC. (US) 2000-06-27 US claimed