SCHEMBL23866845

SCHEMBL23866845

CCC(C)C1CCNC(=O)C1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.35
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
TSHR P16473 1/20 0.31
ALDH2 P05091 1/20 0.31
IRAK4 Q9NWZ3 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
SCHEMBL21527256 0.81 TSHR (0.39) HCAR2TSHR
SCHEMBL20232414 0.81 IRAK4 (0.31) IRAK4
SCHEMBL24567762 0.80 TSHR (0.34) TSHRALDH2IRAK4
SCHEMBL24456537 0.80 TSHR (0.34) TSHRALDH2IRAK4
SCHEMBL2603220 0.80 TSHR (0.34) TSHRALDH2IRAK4
SCHEMBL26733562 0.77 TLR8 (0.33) TSHR
SCHEMBL21494786 0.77 TSHR (0.33) CYP3A4TSHRIRAK4
SCHEMBL24512881 0.74 HRH3 (0.35)
SCHEMBL21107364 0.72 KDM1A (0.32) ALDH2
SCHEMBL4740676 0.71 THRB (0.36) HCAR2ALDH1A1CYP3A4CYP2C9CYP2C19

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-2021195481-A1 SMALL MOLECULE STAT PROTEIN DEGRADERS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2021-09-30 WO disclosed