SCHEMBL28763589

SCHEMBL28763589

O=C1CC(CCCCl)C(=O)O1

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL15095421 0.87 ALDH1A1 (0.46) ALDH1A1TSHR
SCHEMBL12000454 0.87 ALDH1A1 (0.46) ALDH1A1TSHR
SCHEMBL20251191 0.85 ALDH1A1 (0.49) ALDH1A1TSHR
SCHEMBL16522363 0.85 ALDH1A1 (0.49) ALDH1A1TSHR
SCHEMBL16522360 0.85 ALDH1A1 (0.49) ALDH1A1TSHR
SCHEMBL20251162 0.85 ALDH1A1 (0.49) ALDH1A1TSHR
SCHEMBL20251160 0.85 ALDH1A1 (0.49) ALDH1A1TSHR
SCHEMBL4168233 0.83 TSHR (0.44) ALDH1A1TSHR
SCHEMBL20132631 0.80 ALDH1A1 (0.41) ALDH1A1TSHR
SCHEMBL11034202 0.80 ALDH1A1 (0.41) ALDH1A1TSHR

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-114618451-A Weak cation exchange chromatography stationary phase and preparation and application thereof 中国科学院大连化学物理研究所 2022-06-14 CN disclosed