SCHEMBL26010802

SCHEMBL26010802

CCCC(CC)CSSCC

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.31
TDP1 Q9NUW8 1/20 0.31
CYP3A4 P08684 1/20 0.30
TSHR P16473 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
SCHEMBL16899616 0.84
SCHEMBL13364998 0.80 ALDH1A1 (0.31) ALDH1A1TDP1CYP3A4TSHR
SCHEMBL16945809 0.78 ALDH1A1 (0.30) ALDH1A1TDP1
SCHEMBL8856280 0.77 ALDH1A1 (0.54) ALDH1A1TDP1CYP3A4TSHR
SCHEMBL11211294 0.77 ALDH1A1 (0.54) ALDH1A1TDP1CYP3A4TSHR
SCHEMBL26052302 0.76
SCHEMBL16659169 0.74 CYP3A4 (0.30) CYP3A4TSHR
SCHEMBL16899632 0.72 TSHR (0.42) TSHR
SCHEMBL16899612 0.72
SCHEMBL24970800 0.71 LMNA (0.48) ALDH1A1TDP1TSHR

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-20230265501-A1 PHASE PROTECTIVE REAGENT FLOW ORDERING FIRST-CITIZENS BANK & TRUST COMPANY 2023-08-24 US disclosed