SCHEMBL22814520

SCHEMBL22814520

CC1(C)COC2(CCN(C(=O)OC(C)(C)C)CC2)C1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
RECQL P46063 1/20 0.40
GPR119 Q8TDV5 4/20 0.39
HPGD P15428 1/20 0.38
EPHX2 P34913 1/20 0.38
ATM Q13315 1/20 0.38
EPHX1 P07099 1/20 0.37
BUB1 O43683 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
GRM5 P41594 1/20 0.36

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
SCHEMBL31283902 0.87 USP2 (0.46) USP2SMN1; SMN2RECQLGPR119HPGD
SCHEMBL156363 0.84 USP2 (0.56) USP2SMN1; SMN2RECQLGPR119HPGD
SCHEMBL1700547 0.81 USP2 (0.53) USP2SMN1; SMN2RECQLGPR119HPGD
SCHEMBL6825314 0.81 USP2 (0.41) USP2SMN1; SMN2RECQLGPR119HPGD
SCHEMBL18053621 0.80 USP2 (0.59) USP2SMN1; SMN2RECQLGPR119HPGD
SCHEMBL6823515 0.79 USP2 (0.40) USP2SMN1; SMN2RECQLGPR119HPGD
SCHEMBL3436829 0.79 USP2 (0.56) USP2SMN1; SMN2RECQLGPR119HPGD
SCHEMBL27301651 0.79 USP2 (0.50) USP2SMN1; SMN2RECQLGPR119HPGD
SCHEMBL1967958 0.79 USP2 (0.50) USP2SMN1; SMN2RECQLGPR119HPGD
SCHEMBL1222835 0.78 USP2 (0.49) USP2SMN1; SMN2RECQLGPR119HPGD

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
EP-3753941-A1 PYRIMIDINE-FUSED CYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Shanghai Blueray Biopharma Co., Ltd. (CN) 2020-12-23 EP disclosed