SCHEMBL21851985

SCHEMBL21851985

C[C@H]1CC2(CCN(C(=O)OC(C)(C)C)CC2)CO1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
EPHX2 P34913 1/20 0.43
GPR119 Q8TDV5 7/20 0.42
RECQL P46063 1/20 0.42
NAMPT P43490 3/20 0.41
HPGD P15428 1/20 0.40
EPHX1 P07099 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39

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
SCHEMBL22241106 1.00 USP2 (0.46) USP2SMN1; SMN2EPHX2GPR119RECQL
SCHEMBL6635995 0.86 USP2 (0.46) USP2SMN1; SMN2EPHX2GPR119RECQL
SCHEMBL24013325 0.82 USP2 (0.43) USP2SMN1; SMN2EPHX2GPR119RECQL
SCHEMBL31382304 0.82 NAMPT (0.47) USP2SMN1; SMN2EPHX2GPR119RECQL
SCHEMBL31585987 0.81 USP2 (0.46) USP2SMN1; SMN2EPHX2GPR119RECQL
SCHEMBL23265913 0.81 TSHR (0.45) USP2SMN1; SMN2RECQLKDM4EMAPT
SCHEMBL22305158 0.80 USP2 (0.49) USP2SMN1; SMN2EPHX2GPR119RECQL
SCHEMBL21927065 0.80 CYP1A2 (0.43) USP2SMN1; SMN2EPHX2GPR119NAMPT
SCHEMBL22241124 0.79 NAMPT (0.43) USP2SMN1; SMN2EPHX2GPR119NAMPT
SCHEMBL1555865 0.79 USP2 (0.59) USP2SMN1; SMN2EPHX2GPR119RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4282416-A2 PROCESS OF MANUFACTURE OF A COMPOUND FOR INHIBITING THE ACTIVITY OF SHP2 Novartis AG (CH) 2023-11-29 EP disclosed
US-20210346375-A1 PROCESS OF MANUFACTURE OF A COMPOUND FOR INHIBITING THE ACTIVITY OF SHP2, AS WELL AS PRODUCTS RESULTING FROM ACID ADDITION NOVARTIS AG (CH) 2021-11-11 US disclosed
EP-3753941-A1 PYRIMIDINE-FUSED CYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Shanghai Blueray Biopharma Co., Ltd. (CN) 2020-12-23 EP disclosed
WO-2020072656-A1 IMIDOZOPYRIMIDINE DERIVATIVES GILEAD SCIENCES, INC. (US) 2020-04-09 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210346375-A1 PROCESS OF MANUFACTURE OF A COMPOUND FOR INHIBITING THE ACTIVITY OF SHP2, AS WELL AS PRODUCTS RESULTING FROM ACID ADDITION PTPN5, PTPN7, PTPN1 USP2 2291/4885SMN1; SMN2 3575/4885EPHX2 2323/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.