SCHEMBL29117682

SCHEMBL29117682

C=C(C(=O)OC)C1CCC2CCCCC21

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
ITK Q08881 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
SCHEMBL28028504 0.93 ALDH1A1 (0.38) ALDH1A1
SCHEMBL29117712 0.81 ALDH1A1 (0.35) ALDH1A1
SCHEMBL29117825 0.80 PPM1B (0.33) ALDH1A1
SCHEMBL29117554 0.76 TSHR (0.45)
SCHEMBL29117764 0.76 TSHR (0.39) ALDH1A1
SCHEMBL13688357 0.76 ALDH1A1 (0.39) ALDH1A1
SCHEMBL22418760 0.75 ALDH1A1 (0.32) ALDH1A1
SCHEMBL23494236 0.74 SMN1; SMN2 (0.31)
SCHEMBL417319 0.74 CHRM2 (0.47) ALDH1A1
SCHEMBL13688361 0.74 ALDH1A1 (0.38) ALDH1A1

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
CN-116981758-A Thermally responsive brush polymers having a copolymer backbone and copolymer arms 英菲诺姆国际有限公司 2023-10-31 CN disclosed