SCHEMBL707302

SCHEMBL707302

CC(C)(C)N(C(=O)O)C1CCN(CCN2C(=O)COc3ccc(Cl)cc32)CC1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.56
KCNH2 Q12809 2/20 0.51
USP2 O75604 1/20 0.48
HTT P42858 1/20 0.48
UTS2R Q9UKP6 5/20 0.47
CHRM1 P11229 1/20 0.46
DRD4 P21917 1/20 0.46
THRB P10828 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
KDM4E B2RXH2 1/20 0.44
RAB9A P51151 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL709161 0.91 KCNH2 (0.51) KMOKCNH2HTTCHRM1
SCHEMBL705652 0.90 TSHR (0.53) HTTCHRM1MEN1KMT2AMAPT
SCHEMBL708589 0.89 KCNH2 (0.51) KMOKCNH2CHRM1
SCHEMBL707115 0.88 KCNH2 (0.56) KMOKCNH2HTTCHRM1MAPT
SCHEMBL708406 0.87 KCNH2 (0.55) KCNH2CHRM1MEN1KMT2ANPSR1
SCHEMBL704650 0.87 CHRM1 (0.60) KCNH2HTTUTS2RCHRM1DRD4
SCHEMBL706189 0.86 KCNH2 (0.54) KCNH2CHRM1THRBKMT2A
SCHEMBL705187 0.86 KCNH2 (0.53) KMOKCNH2HTTCHRM1MAPT
SCHEMBL705943 0.86 KCNH2 (0.46) KCNH2CHRM1THRBKMT2A
SCHEMBL708216 0.86 KCNH2 (0.54) KMOKCNH2UTS2RCHRM1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124602-B2 Compounds for the treatment of multi-drug resistant bacterial infections ASTRAZENECA AB (SE) 2012-02-28 US disclosed
US-20110092495-A1 COMPOUNDS FOR THE TREATMENT OF MULTI-DRUG RESISTANT BACTERIAL INFECTIONS ASTRAZENECA AB (SE) 2011-04-21 US disclosed
EP-2289890-A1 Compounds for the treatment of multi-drug resistant bacterial infections AstraZeneca AB (SE) 2011-03-02 EP 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-20110092495-A1 COMPOUNDS FOR THE TREATMENT OF MULTI-DRUG RESISTANT BACTERIAL INFECTIONS PIGS, BPGM, IPMK KMO 2826/4885KCNH2 4242/4885USP2 3698/4885

“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.