SCHEMBL28795352

SCHEMBL28795352

COC(=O)[C@H](C)OC(=O)N1CCOCC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.51
RECQL P46063 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
USP2 O75604 1/20 0.46
PKM P14618 1/20 0.46
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.45
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CYP2C19 P33261 2/20 0.42
CYP3A4 P08684 1/20 0.42
GLA P06280 1/20 0.41
GAA P10253 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
TP53 P04637 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
MGLL Q99685 1/20 0.40

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
Cyclohexane SCHEMBL27513465 0.97 TSHR (0.49) TSHRRECQLSMN1; SMN2USP2PKM
SCHEMBL15818433 0.83 TSHR (0.67) TSHRRECQLSMN1; SMN2USP2LMNA
SCHEMBL15831122 0.83 TSHR (0.67) TSHRRECQLSMN1; SMN2USP2LMNA
SCHEMBL7279994 0.80 TSHR (0.49) TSHRRECQLSMN1; SMN2USP2PKM
SCHEMBL12206737 0.80 TSHR (0.55) TSHRRECQLSMN1; SMN2USP2PKM
SCHEMBL697035 0.78 TSHR (0.53) TSHRRECQLSMN1; SMN2USP2PKM
SCHEMBL296555 0.78 TSHR (0.53) TSHRRECQLSMN1; SMN2USP2PKM
SCHEMBL17894913 0.78 TSHR (0.53) TSHRRECQLSMN1; SMN2USP2PKM
SCHEMBL28795395 0.78 TSHR (0.42) TSHRRECQLSMN1; SMN2USP2PKM
SCHEMBL208812 0.77 TSHR (0.61) TSHRRECQLSMN1; SMN2USP2LMNA

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-114805340-A Process for producing imidazopyridine compound and intermediate thereof 武汉人福创新药物研发中心有限公司 2022-07-29 CN disclosed
CN-114805237-A Process for producing heterocyclic compound and intermediate thereof 武汉人福创新药物研发中心有限公司 2022-07-29 CN disclosed