SCHEMBL23740290

SCHEMBL23740290

COCCCCCCCCC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
HRH3 Q9Y5N1 1/20 0.34
ARG1 P05089 1/20 0.32
ARG2 P78540 1/20 0.32
HTR1A P08908 2/20 0.30
HTR1B P28222 2/20 0.30
HTR1D P28221 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
SCHEMBL3150458 1.00 ALDH1A1 (0.41) ALDH1A1HRH3ARG1ARG2HTR1A
SCHEMBL21742288 1.00 ALDH1A1 (0.41) ALDH1A1HRH3ARG1ARG2HTR1A
SCHEMBL114509 1.00 ALDH1A1 (0.41) ALDH1A1HRH3ARG1ARG2HTR1A
SCHEMBL15183780 1.00 ALDH1A1 (0.41) ALDH1A1HRH3ARG1ARG2HTR1A
SCHEMBL10226529 0.97 ALDH1A1 (0.37) ALDH1A1HRH3ARG1ARG2
SCHEMBL4567658 0.88
SCHEMBL24808630 0.82 KDM4E (0.40) ALDH1A1
SCHEMBL29926359 0.80 HRH3 (0.47) HRH3HTR1AHTR1BHTR1D
SCHEMBL30495486 0.80 HRH3 (0.35) HRH3HTR1AHTR1BHTR1D
SCHEMBL4451768 0.80 HRH3 (0.47) HRH3HTR1AHTR1BHTR1D

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
EP-3504340-B1 TAGGED NUCLEOTIDES USEFUL FOR NANOPORE DETECTION HOFFMANN LA ROCHE (CH) 2021-08-11 EP disclosed