SCHEMBL5244191

SCHEMBL5244191

C=CC(=O)N(Cc1ccccc1)C1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.55
JAK1 P23458 1/20 0.55
HSD11B1 P28845 1/20 0.52
GPR119 Q8TDV5 6/20 0.50
STS P08842 1/20 0.50
PTPRB P23467 1/20 0.48
PTPN11 Q06124 1/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
GAA P10253 1/20 0.48
THRB P10828 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
KDM4E B2RXH2 1/20 0.47
PKM P14618 1/20 0.47
DCUN1D1 Q96GG9 1/20 0.47
USP30 Q70CQ3 2/20 0.47

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
SCHEMBL618193 0.86 JAK2 (0.59) JAK2JAK1HSD11B1GPR119STS
SCHEMBL13853353 0.84 OPRM1 (0.60) JAK2JAK1HSD11B1GPR119STS
SCHEMBL3012474 0.83 JAK2 (0.62) JAK2JAK1HSD11B1GPR119STS
SCHEMBL1624526 0.82 HSD11B1 (0.66) JAK2JAK1HSD11B1GPR119STS
SCHEMBL2966618 0.82 DCUN1D1 (0.57) JAK2JAK1DCUN1D1
SCHEMBL803527 0.82 JAK2 (0.74) JAK2JAK1HSD11B1GPR119STS
SCHEMBL5567646 0.81 GPR119 (0.46) GPR119
SCHEMBL3764740 0.80 JAK2 (0.52) JAK2JAK1HSD11B1GPR119STS
SCHEMBL7136590 0.79 CCR5 (0.55) JAK2JAK1STS
SCHEMBL12122824 0.79 JAK2 (0.58) JAK2JAK1HSD11B1GPR119STS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7238694-B2 Rifamycin imino derivatives effective against drug-resistant microbes CUMBRE PHARMACEUTICALS, INC. (US) 2007-07-03 US disclosed
US-7229996-B2 Rifamycin derivatives CUMBRE PHARMACEUTICALS INC. (US) 2007-06-12 US disclosed
US-7229996-B2 Rifamycin derivatives CUMBRE PHARMACEUTICALS INC. (US) 2007-06-12 US disclosed
US-7229996-B2 Rifamycin derivatives CUMBRE PHARMACEUTICALS INC. (US) 2007-06-12 US disclosed
EP-1781670-A1 RIFAMYCIN DERIVATIVES FOR TREATING MICROBIAL INFECTIONS Cumbre Pharmaceuticals Inc. (US) 2007-05-09 EP disclosed
EP-1723150-A1 RIFAMYCIN IMINO DERIVATIVES EFFECTIVE AGAINST DRUG-RESISTANT MICROBES Cumbre Pharmaceuticals Inc. (US) 2006-11-22 EP disclosed
WO-2006012470-A1 RIFAMYCIN DERIVATIVES FOR TREATING MICROBIAL INFECTIONS CUMBRE PHARMACEUTICALS INC. (US) 2006-02-02 WO disclosed
US-20060019985-A1 Rifamycin derivatives CUMBRE INC. (US) 2006-01-26 US disclosed
US-20050209210-A1 Rifamycin imino derivatives effective against drug-resistant microbes CUMBRE INC. (US) 2005-09-22 US disclosed
WO-2005070941-A1 RIFAMYCIN IMINO DERIVATIVES EFFECTIVE AGAINST DRUG-RESISTANT MICROBES CUMBRE PHARMACEUTICALS INC. (US) 2005-08-04 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 (2 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-20060019985-A1 Rifamycin derivatives RIF1, NQO1, MRM1 JAK2 4431/4885JAK1 4187/4885HSD11B1 907/4885
US-20050209210-A1 Rifamycin imino derivatives effective against drug-resistant microbes RIF1, TOP1, TOP2A JAK2 4624/4885JAK1 4702/4885HSD11B1 1247/4885

“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.