SCHEMBL31454764

SCHEMBL31454764

NC(=O)C1(CC(O)CO)CCCCC1

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.35
THRB P10828 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
SCHEMBL28502433 0.77 MME (0.34)
SCHEMBL11381051 0.76 CYP2C19 (0.38) CYP2C19
SCHEMBL14795213 0.76 MME (0.36) CYP2C19
SCHEMBL6136974 0.74 CYP2C19 (0.43) CYP2C19
SCHEMBL9524739 0.74 CYP2C19 (0.36) CYP2C19
SCHEMBL781736 0.73 CETP (0.48) CYP2C19
SCHEMBL1516357 0.72 CYP2C19 (0.39) CYP2C19
SCHEMBL1231768 0.71 CYP2C19 (0.40) CYP2C19
SCHEMBL5132557 0.70 ALDH1A1 (0.45) CYP2C19
SCHEMBL1768108 0.69 HDAC1 (0.38) CYP2C19

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-119639034-A Borate-based crosslinked polymers with improved processability 巴黎市工业物理化学学校 2025-03-18 CN disclosed