SCHEMBL1154988

SCHEMBL1154988

CN(C)CCN(CC1CCNC1)C1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.40
HPGD P15428 1/20 0.39
RECQL P46063 1/20 0.38
EPHX1 P07099 1/20 0.38
KDM4E B2RXH2 2/20 0.37
MAPT P10636 1/20 0.37
THRB P10828 1/20 0.37
DDB1 Q16531 2/20 0.37
CRBN Q96SW2 2/20 0.37
PKM P14618 1/20 0.37

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
SCHEMBL1088765 0.76 KDM4E (0.42) GPR119HPGDRECQLEPHX1KDM4E
SCHEMBL19083252 0.76 SLC6A1 (0.36)
SCHEMBL6003485 0.75 HPGD (0.46) GPR119HPGDRECQLEPHX1KDM4E
SCHEMBL31697753 0.75 GPR119 (0.43) GPR119HPGDRECQLEPHX1KDM4E
SCHEMBL23267860 0.75 HPGD (0.48) GPR119HPGDRECQLEPHX1KDM4E
SCHEMBL14497234 0.75 GPR119 (0.50) GPR119HPGDRECQLEPHX1KDM4E
SCHEMBL15000860 0.75 GNAI3 (0.51) GPR119HPGDRECQLEPHX1KDM4E
SCHEMBL5240935 0.74 CNR1 (0.43) HPGDRECQLEPHX1KDM4EMAPT
SCHEMBL30706198 0.74 CNR1 (0.43) HPGDRECQLEPHX1KDM4EMAPT
SCHEMBL25572001 0.74 CNR1 (0.43) HPGDRECQLEPHX1KDM4EMAPT

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-7884099-B2 such as (R)-5'-[3-{1-(4-{1-[1-(3-Carboxy-1-cyclopropyl-7-fluoro-9-methyl-4-oxo-4H-quinolizine-8-yl)-pyrrolidin-3-yl-cyclopropyl]-methylamino}-piperidin-1-yl]-3'-hydroxy-benzoxazinorifamycin, useful as bactericides for the treatment of bacterial infections CUMBRE IP VENTURES, L.P. (US) 2011-02-08 US disclosed
US-20090143373-A1 QUINOLONE CARBOXYLIC ACID-SUBSTITUTED RIFAMYCIN DERIVATIVES CUMBRE PHARMACEUTICALS INC. (US) 2009-06-04 US disclosed
WO-2009064792-A1 QUINOLONE CARBOXYLIC ACID-SUBSTITUTED RIFAMYCIN DERIVATIVES CUMBRE PHARMACEUTICALS INC. (US) 2009-05-22 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-20090143373-A1 QUINOLONE CARBOXYLIC ACID-SUBSTITUTED RIFAMYCIN DERIVATIVES NQO2, SDHA, QPCT GPR119 2866/4885HPGD 331/4885RECQL 864/4885

“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.