SCHEMBL5895161

SCHEMBL5895161

CCC(=O)C1COC2(CCN(C(=O)OC(C)(C)C)CC2)C1=O

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ DDB1 Q16531 1/20 0.38
▸ CRBN Q96SW2 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ EPHX2 P34913 1/20 0.38
▸ GPR119 Q8TDV5 5/20 0.37
▸ RECQL P46063 1/20 0.36
▸ MAPT P10636 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ AVPR1A P37288 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ OPRD1 P41143 1/20 0.35
▸ OPRK1 P41145 1/20 0.35

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
SCHEMBL23002541 0.81 USP2 (0.44) USP2SMN1; SMN2DDB1CRBNHPGD
SCHEMBL4792848 0.79 DDB1 (0.43) USP2SMN1; SMN2DDB1CRBNHPGD
SCHEMBL17725623 0.73 USP2 (0.41) USP2SMN1; SMN2DDB1CRBNHPGD
SCHEMBL19379559 0.73 USP2 (0.41) USP2SMN1; SMN2DDB1CRBNHPGD
SCHEMBL17760295 0.73 USP2 (0.41) USP2SMN1; SMN2DDB1CRBNHPGD
SCHEMBL22814430 0.73 USP2 (0.46) USP2SMN1; SMN2DDB1CRBNHPGD
SCHEMBL21843465 0.72 USP2 (0.49) USP2SMN1; SMN2DDB1CRBNHPGD
SCHEMBL22799096 0.71 USP2 (0.41) USP2SMN1; SMN2DDB1CRBNHPGD
SCHEMBL5897211 0.71 DDB1 (0.42) USP2SMN1; SMN2DDB1CRBNEPHX2
SCHEMBL16914415 0.70 USP2 (0.50) USP2SMN1; SMN2DDB1CRBNHPGD

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
US-7091211-B2 Cyclopentyl modulators of chemokine receptor activity MERCK & CO., INC. (US) 2006-08-15 — — US disclosed
US-20050070609-A1 Cyclopentyl modulators of chemokine receptor activity MERCK SHARP & DOHME CORP. 2005-03-31 — — 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-20050070609-A1 Cyclopentyl modulators of chemokine receptor activity CCR5, CXCR1, ACKR3 USP2 4590/4885SMN1; SMN2 4725/4885DDB1 1167/4885

“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.

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