SCHEMBL9948965

SCHEMBL9948965

CC(C)(C)OC(=O)N1CCC2(CCC(=O)N2C(=O)OC(C)(C)C)CC1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
DDB1 Q16531 1/20 0.41
CRBN Q96SW2 1/20 0.41
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39
HPGD P15428 1/20 0.38
EPHX2 P34913 1/20 0.38
TSHR P16473 2/20 0.38
ALOX15 P16050 1/20 0.38
ATM Q13315 1/20 0.38
TACR1 P25103 1/20 0.38
GPR119 Q8TDV5 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ESR2 Q92731 1/20 0.37
RECQL P46063 1/20 0.37

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
SCHEMBL9948963 0.92 USP2 (0.42) USP2SMN1; SMN2DDB1CRBNKDM4E
SCHEMBL20456344 0.89 CHRM2 (0.37) USP2SMN1; SMN2DDB1CRBNKDM4E
SCHEMBL6921819 0.86 CHRM2 (0.35) USP2SMN1; SMN2DDB1CRBNKDM4E
SCHEMBL6922466 0.81 CHRM2 (0.32) USP2SMN1; SMN2DDB1CRBN
SCHEMBL29348855 0.81 USP2 (0.38) USP2SMN1; SMN2DDB1CRBNESR2
SCHEMBL33525787 0.80 CHRM2 (0.35) USP2SMN1; SMN2DDB1CRBNHPGD
SCHEMBL6921988 0.80 CRBN (0.35) DDB1CRBNKDM4EMAPTTHRB
SCHEMBL5895323 0.77 USP2 (0.47) USP2SMN1; SMN2DDB1CRBNKDM4E
SCHEMBL25783891 0.77 BRD4 (0.38) SMN1; SMN2DDB1CRBNHPGD
SCHEMBL3658980 0.76 BUB1 (0.38) USP2SMN1; SMN2DDB1CRBNMEN1

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
WO-2012101487-A1 DI/TRI-AZA-SPIRO-C9-C11ALKANES NOVARTIS AG (CH) 2012-08-02 WO disclosed
US-20120165331-A1 Di/tri-aza-spiro-C9-C11alkanes AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2012-06-28 US 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-20120165331-A1 Di/tri-aza-spiro-C9-C11alkanes TACR2, TACR1, AGTR1 USP2 4495/4885SMN1; SMN2 2847/4885DDB1 250/4885

“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.