SCHEMBL19967327

SCHEMBL19967327

CCCCC1(C)C(C)CC=C2C1CCC1CCCC21C

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CDC25A P30304 5/20 0.33
▸ CDC25B P30305 3/20 0.33
▸ CYP19A1 P11511 3/20 0.32

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
SCHEMBL18688155 0.83 CDC25A (0.35) CDC25ACDC25B
SCHEMBL18688659 0.82 CDC25A (0.39) CDC25ACDC25BCYP19A1
SCHEMBL18688311 0.69 CYP19A1 (0.35) CYP19A1
SCHEMBL18687835 0.65 ALDH1A1 (0.43) CYP19A1
SCHEMBL18688341 0.64 CYP19A1 (0.39) CYP19A1
SCHEMBL23842575 0.61 CDC25A (0.38) CDC25ACDC25B
SCHEMBL28223446 0.60 TRPV1 (0.31) —
SCHEMBL23830076 0.60 CDC25A (0.39) CDC25ACDC25B
SCHEMBL11490606 0.57 NR1H3 (0.31) —
SCHEMBL15066450 0.55 CYP1A2 (0.40) —

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-2018047175-A1 COMPOSITIONS COMPRISING TRITERPENOIDS AND USES THEREOF FOR TREATING OPTIC NEUROPATHY REGENERA PHARMA LTD. (IL) 2018-03-15 — — WO disclosed
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