SCHEMBL23503567

SCHEMBL23503567

C=CCCC(C(C)CC)N(C)C

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.35
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL20676457 0.82 TSHR (0.32) TSHR
SCHEMBL23776161 0.77 TSHR (0.46) TSHRALDH1A1
SCHEMBL27974597 0.77 TSHR (0.41) TSHRALDH1A1
SCHEMBL22096767 0.74 TSHR (0.32) TSHR
SCHEMBL24309234 0.73
SCHEMBL11563132 0.72
SCHEMBL17213406 0.71 TSHR (0.36) TSHRALDH1A1
SCHEMBL13452816 0.70 TSHR (0.32) TSHR
SCHEMBL25785610 0.70 TSHR (0.40) TSHRALDH1A1
SCHEMBL4902276 0.69

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-11034876-B1 Calcium-resistant zwitterionic polymer, preparation method and application thereof, and water-based drilling fluid containing polymer as dispersant CHINA UNIVERSITY OF PETROLEUM (BEIJING) (CN) 2021-06-15 US disclosed