SCHEMBL5764149

SCHEMBL5764149

CC(C)(C)OC(=O)N1CC[C@]2(CCOC2)[C@H](O)C1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
RECQL P46063 1/20 0.42
NR1H2 P55055 1/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
GPR119 Q8TDV5 2/20 0.35
HPGD P15428 1/20 0.35
EPHX2 P34913 1/20 0.35
NAMPT P43490 2/20 0.34
EPHX1 P07099 1/20 0.34
KDM1A O60341 1/20 0.34
DDB1 Q16531 1/20 0.34
CRBN Q96SW2 1/20 0.34
USP30 Q70CQ3 1/20 0.34

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
SCHEMBL5766899 1.00 USP2 (0.47) USP2SMN1; SMN2RECQLNR1H2MEN1
SCHEMBL5764143 1.00 USP2 (0.47) USP2SMN1; SMN2RECQLNR1H2MEN1
SCHEMBL9942499 0.84 USP2 (0.44) USP2SMN1; SMN2RECQLNR1H2MEN1
SCHEMBL734925 0.84 USP2 (0.44) USP2SMN1; SMN2RECQLNR1H2MEN1
SCHEMBL733741 0.84 USP2 (0.44) USP2SMN1; SMN2RECQLNR1H2MEN1
SCHEMBL4693768 0.82 USP2 (0.50) USP2SMN1; SMN2RECQLGPR119HPGD
SCHEMBL24938934 0.82 HPGD (0.42) USP2SMN1; SMN2RECQLNR1H2MEN1
SCHEMBL30744670 0.82 HPGD (0.42) USP2SMN1; SMN2RECQLNR1H2MEN1
SCHEMBL18204175 0.78 NR1H2 (0.40) USP2SMN1; SMN2RECQLNR1H2MEN1
SCHEMBL22016006 0.78 USP2 (0.39) USP2SMN1; SMN2RECQLGPR119EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1286967-B1 CYCLOHEXANE DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS MERCK SHARP & DOHME (GB) 2006-09-27 EP disclosed
US-7105507-B2 Cyclohexane derivatives and their use as therapeutic agents MERCK SHARP & DOHME LIMITED (GB) 2006-09-12 US disclosed
US-20030236250-A1 Cyclohexane derivatives and their use as therapeutic agents MERCK SHARP & DOHME LTD. (GB) 2003-12-25 US disclosed
EP-1286967-A1 CYCLOHEXANE DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS MERCK SHARP & DOHME LTD. (GB) 2003-03-05 EP disclosed
WO-2001087838-A1 CYCLOHEXANE DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS MERCK SHARP & DOHME LIMITED (GB) 2001-11-22 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-20030236250-A1 Cyclohexane derivatives and their use as therapeutic agents CNR2, CNR1, HTR1A USP2 4091/4885SMN1; SMN2 3052/4885RECQL 463/4885

“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.