SCHEMBL27008262

SCHEMBL27008262

CC=C(C)C(=O)OCCC(O)O

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
ALOX15 P16050 1/20 0.34
THRB P10828 1/20 0.31

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
SCHEMBL3292504 0.86 ALOX15 (0.37) CYP2D6CYP2C19ALOX15
SCHEMBL3292506 0.86 ALOX15 (0.37) CYP2D6CYP2C19ALOX15
SCHEMBL3507005 0.83 CYP19A1 (0.41) ALOX15
SCHEMBL872903 0.83 CYP19A1 (0.41) ALOX15
SCHEMBL11580461 0.83 ALOX15 (0.34) CYP2D6CYP2C19ALOX15THRB
SCHEMBL872902 0.83 CYP19A1 (0.41) ALOX15
SCHEMBL31361997 0.82 CYP2C19 (0.34) CYP2D6CYP2C19ALOX15
SCHEMBL31362022 0.82 CYP2C19 (0.34) CYP2D6CYP2C19ALOX15
SCHEMBL10712299 0.82 FAAH (0.39) ALOX15
SCHEMBL418569 0.82 THRB (0.41) CYP2C19THRB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240082457-A1 HARD TISSUE REPAIR ADHESIVE COMPOSITION AND HARD TISSUE REPAIR KIT THEREOF Jiaxing Jingyin Biotechnology Co., Ltd. (CN) 2024-03-14 US disclosed
US-20240016973-A1 ADHESIVE COMPOSITION FOR HARD TISSUE REPAIR Jiaxing Jingyin Biotechnology Co., Ltd. (CN) 2024-01-18 US disclosed
CN-1774271-A Absorbent polymer compositions, medical articles, and methods 3M INNOVATIVE PROPERTIES CO (US) 2006-05-17 CN disclosed