SCHEMBL28359649

SCHEMBL28359649

CCCCCCCCCCCCCCCCCC[N+]1(CC)CCOCC1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 1/20 0.40
TSHR P16473 1/20 0.33
THRB P10828 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
EPHX1 P07099 1/20 0.32
GNAI3 P08754 1/20 0.32
GNAO1 P09471 1/20 0.32
GNAI1 P63096 1/20 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
SCHEMBL4452005 1.00 CDC25A (0.40) CDC25ATSHRTHRBCTDSP1EPHX1
SCHEMBL4058936 1.00 CDC25A (0.40) CDC25ATSHRTHRBCTDSP1EPHX1
SCHEMBL10034058 1.00 CDC25A (0.40) CDC25ATSHRTHRBCTDSP1EPHX1
SCHEMBL4067219 1.00 CDC25A (0.40) CDC25ATSHRTHRBCTDSP1EPHX1
Hydrochloric Acid SCHEMBL9784486 0.98 CDC25A (0.39) CDC25ATSHRTHRBCTDSP1EPHX1
Hydrochloric Acid SCHEMBL3170172 0.98 CDC25A (0.39) CDC25ATSHRTHRBCTDSP1EPHX1
Fluoride Ion SCHEMBL2400218 0.98 CDC25A (0.39) CDC25ATSHRTHRBCTDSP1EPHX1
SCHEMBL10537448 0.91 CDC25A (0.41) CDC25ATSHRTHRBCTDSP1EPHX1
SCHEMBL4071466 0.91 CDC25A (0.41) CDC25ATSHRTHRBCTDSP1EPHX1
SCHEMBL3275678 0.91 CDC25A (0.41) CDC25ATSHRTHRBCTDSP1EPHX1

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
CN-110791964-B Treating agent for elastic fiber and elastic fiber 竹本油脂株式会社 2020-10-23 CN disclosed
CN-110791964-A Treating agent for elastic fiber and elastic fiber 竹本油脂株式会社 2020-02-14 CN disclosed