SCHEMBL29040317

SCHEMBL29040317

CC(C)(C)OC(=O)N1C(c2ccccc2)CC[C@@H]1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 3/20 0.51
ABCB1 P08183 1/20 0.47
RIPK1 Q13546 2/20 0.45
GPR119 Q8TDV5 1/20 0.44

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
SCHEMBL6183606 1.00 FFAR2 (0.51) FFAR2ABCB1RIPK1GPR119
SCHEMBL5156869 1.00 FFAR2 (0.51) FFAR2ABCB1RIPK1GPR119
SCHEMBL475744 1.00 FFAR2 (0.51) FFAR2ABCB1RIPK1GPR119
SCHEMBL30720983 1.00 FFAR2 (0.51) FFAR2ABCB1RIPK1GPR119
SCHEMBL2896922 1.00 FFAR2 (0.51) FFAR2ABCB1RIPK1GPR119
SCHEMBL475745 1.00 FFAR2 (0.51) FFAR2ABCB1RIPK1GPR119
SCHEMBL859599 1.00 FFAR2 (0.51) FFAR2ABCB1RIPK1GPR119
SCHEMBL28511990 0.90 ABCB1 (0.49) FFAR2ABCB1RIPK1GPR119
SCHEMBL4870228 0.90 ABCB1 (0.52) ABCB1RIPK1GPR119
SCHEMBL14074143 0.90 ABCB1 (0.52) ABCB1RIPK1GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117777121-A Compounds and uses thereof 詹森药业有限公司 2024-03-29 CN disclosed
CN-110099898-B Compounds and uses thereof 优曼尼蒂治疗公司 2023-07-25 CN disclosed