SCHEMBL2924964

SCHEMBL2924964

CC(C)N1CCN(C(=O)[C@H]2CC[C@H](Oc3ccc(-c4nnco4)cc3)CC2)CC1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.46
MEN1 O00255 1/20 0.46
HSD17B10 Q99714 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
LMNA P02545 2/20 0.44
TSHR P16473 1/20 0.42
HRH3 Q9Y5N1 7/20 0.41
GAA P10253 2/20 0.41
PKM P14618 2/20 0.41
POLB P06746 1/20 0.40
GPR119 Q8TDV5 1/20 0.40
MAPT P10636 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
SCHEMBL2930146 1.00 KMT2A (0.46) KMT2AMEN1HSD17B10SMN1; SMN2L3MBTL1
SCHEMBL2927293 0.84 FAAH (0.47) KMT2ALMNAHRH3POLBGPR119
SCHEMBL2927290 0.84 FAAH (0.47) KMT2ALMNAHRH3POLBGPR119
SCHEMBL2930563 0.84 LMNA (0.47) KMT2ALMNAHRH3POLBMAPT
SCHEMBL2930561 0.84 LMNA (0.47) KMT2ALMNAHRH3POLBMAPT
SCHEMBL2929889 0.83 LMNA (0.44) KMT2AL3MBTL1LMNAHRH3POLB
SCHEMBL2929888 0.83 LMNA (0.44) KMT2AL3MBTL1LMNAHRH3POLB
SCHEMBL2924545 0.83 MAPT (0.44) KMT2ALMNAHRH3POLBMAPT
SCHEMBL2924546 0.83 MAPT (0.44) KMT2ALMNAHRH3POLBMAPT
SCHEMBL2926250 0.82 LMNA (0.43) KMT2AL3MBTL1LMNAHRH3POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2158189-B1 CYCLOHEXYL DERIVATIVES HOFFMANN LA ROCHE (CH) 2010-09-15 EP claimed
US-7544683-B2 Cyclohexyl derivatives HOFFMANN-LA ROCHE INC. (US) 2009-06-09 US claimed
US-20090005380-A1 CYCLOHEXYL DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-01-01 US claimed
EP-2158189-B1 CYCLOHEXYL DERIVATIVES HOFFMANN LA ROCHE (CH) 2010-09-15 EP disclosed
US-7544683-B2 Cyclohexyl derivatives HOFFMANN-LA ROCHE INC. (US) 2009-06-09 US disclosed
US-20090005380-A1 CYCLOHEXYL DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-01-01 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-20090005380-A1 CYCLOHEXYL DERIVATIVES HRH3, HRH4, HCAR2 KMT2A 359/4885MEN1 2725/4885HSD17B10 713/4885

“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.