SCHEMBL29939711

SCHEMBL29939711

COC(=O)c1ccc(OCC2(F)CCN(C(=O)OC(C)(C)C)CC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.52
GPR119 Q8TDV5 9/20 0.46
JAK2 O60674 1/20 0.45
JAK1 P23458 1/20 0.45
MAPT P10636 3/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
MMP13 P45452 1/20 0.44
ADAM17 P78536 1/20 0.44
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HDAC1 Q13547 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL5155331 0.80 MAPT (0.43) PKMMAPTMEN1KMT2ASMN1; SMN2
SCHEMBL241130 0.78 GPR119 (0.59) PKMGPR119HDAC1ALDH1A1
SCHEMBL7402974 0.77 GPR119 (0.64) PKMGPR119MAPTALDH1A1
SCHEMBL457656 0.77 GPR119 (0.47) GPR119
SCHEMBL25320725 0.76 GPR119 (0.48) PKMGPR119JAK2JAK1MEN1
SCHEMBL7376662 0.76 GPR119 (0.70) PKMGPR119ALDH1A1
SCHEMBL31330775 0.76 GPR119 (0.54) PKMGPR119HDAC1ALDH1A1
SCHEMBL15368794 0.76 USP2 (0.47) GPR119SMN1; SMN2
SCHEMBL7401949 0.76 GPR119 (0.54) GPR119MAPTALDH1A1
SCHEMBL17762747 0.75 PKM (0.50) PKMGPR119JAK2JAK1MAPT

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-115215787-A Somatostatin receptor 5 antagonists and uses thereof 中国科学院上海药物研究所 2022-10-21 CN disclosed