SCHEMBL5895670

SCHEMBL5895670

C=CC1C(O)CCC12CCN(C(=O)OC(C)(C)C)CC2

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.41
▸ USP2 O75604 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ GPR119 Q8TDV5 7/20 0.40
▸ RECQL P46063 1/20 0.39
▸ EPHX1 P07099 1/20 0.39
▸ DDB1 Q16531 1/20 0.39
▸ CRBN Q96SW2 1/20 0.39
▸ EPHX2 P34913 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ PTPN2 P17706 1/20 0.36
▸ PTPN1 P18031 1/20 0.36
▸ PTPN6 P29350 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
SCHEMBL5895376 0.80 USP2 (0.37) HPGDUSP2SMN1; SMN2GPR119RECQL
SCHEMBL22284182 0.79 GPR119 (0.42) HPGDUSP2SMN1; SMN2GPR119RECQL
SCHEMBL29548956 0.79 HPGD (0.48) HPGDUSP2SMN1; SMN2GPR119RECQL
SCHEMBL20618024 0.76 HPGD (0.46) HPGDUSP2SMN1; SMN2GPR119RECQL
SCHEMBL24170473 0.76 HPGD (0.48) HPGDUSP2SMN1; SMN2GPR119RECQL
SCHEMBL1344048 0.75 USP2 (0.50) HPGDUSP2SMN1; SMN2GPR119RECQL
SCHEMBL22799171 0.75 HPGD (0.47) HPGDUSP2SMN1; SMN2GPR119RECQL
SCHEMBL28622796 0.75 HPGD (0.47) HPGDUSP2SMN1; SMN2GPR119RECQL
SCHEMBL23826942 0.75 HPGD (0.47) HPGDUSP2SMN1; SMN2GPR119RECQL
SCHEMBL15769569 0.75 HPGD (0.47) HPGDUSP2SMN1; SMN2GPR119RECQL

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 HPGD 537/4885USP2 4590/4885SMN1; SMN2 4725/4885

“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.

Send feedback