SCHEMBL642365

SCHEMBL642365

CC(C)(C)OC(=O)N1CC[C@@H](CN2CCN(Cc3ccccc3)CC2)C1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.52
PKM P14618 1/20 0.52
GPR119 Q8TDV5 2/20 0.52
JAK2 O60674 1/20 0.52
JAK1 P23458 1/20 0.52
TP53 P04637 4/20 0.50
THRB P10828 1/20 0.50
MAPT P10636 1/20 0.50
CHRM4 P08173 1/20 0.49
STS P08842 1/20 0.49
HTR1A P08908 1/20 0.47
SIGMAR1 Q99720 1/20 0.47
CNR1 P21554 1/20 0.47
BRD4 O60885 2/20 0.47
BCHE P06276 1/20 0.47
HTR6 P50406 1/20 0.47
ACHE P22303 1/20 0.46

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
SCHEMBL641206 1.00 KDM4E (0.52) KDM4EPKMGPR119JAK2JAK1
SCHEMBL641207 1.00 KDM4E (0.52) KDM4EPKMGPR119JAK2JAK1
SCHEMBL2959964 0.93 HTR6 (0.54) GPR119JAK2JAK1TP53THRB
SCHEMBL2959968 0.93 HTR6 (0.54) GPR119JAK2JAK1TP53THRB
SCHEMBL14497204 0.90 KDM4E (0.51) KDM4EPKMGPR119JAK2JAK1
SCHEMBL23270010 0.90 TP53 (0.53) KDM4EPKMGPR119TP53THRB
SCHEMBL30179036 0.87 SMN1; SMN2 (0.53) KDM4EPKMGPR119JAK2JAK1
SCHEMBL30602886 0.87 SMN1; SMN2 (0.53) KDM4EPKMGPR119JAK2JAK1
SCHEMBL26705305 0.87 SMN1; SMN2 (0.53) KDM4EPKMGPR119JAK2JAK1
SCHEMBL20274773 0.86 TP53 (0.50) KDM4EPKMGPR119TP53THRB

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
US-8791148-B2 Substituted benzimidazolone derivatives, medicaments comprising them and their use AbbVie Deutschland GmbH & Co. KG (DE) 2014-07-29 US disclosed
US-20120172335-A1 SUBSTITUTED BENZIMIDAZOLONE DERIVATIVES, MEDICAMENTS COMPRISING THEM AND THEIR USE ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2012-07-05 US disclosed
US-8119676-B2 Substituted benzimidazolone derivatives, medicaments comprising them and their use Abbott GmbH & Co. HG (DE) 2012-02-21 US disclosed
US-20100152168-A1 SUBSTITUTED BENZIMIDAZOLONE DERIVATIVES, MEDICAMENTS COMPRISING THEM AND THEIR USE ABBOTT GMBH & CO. KG (DE) 2010-06-17 US disclosed
EP-2061769-A1 SUBSTITUTED BENZIMIDAZOLONE DERIVATIVES, MEDICAMENTS COMPRISING THEM AND THEIR USE Abbott GmbH & Co. KG (DE) 2009-05-27 EP disclosed
WO-2008025736-A1 SUBSTITUTED BENZIMIDAZOLONE DERIVATIVES, MEDICAMENTS COMPRISING THEM AND THEIR USE ABBOTT GMBH & CO. KG (DE) 2008-03-06 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-20100152168-A1 SUBSTITUTED BENZIMIDAZOLONE DERIVATIVES, MEDICAMENTS COMPRISING THEM AND THEIR USE AVPR2, AVPR1B, AVPR1A KDM4E 4508/4885PKM 1171/4885GPR119 830/4885
US-20120172335-A1 SUBSTITUTED BENZIMIDAZOLONE DERIVATIVES, MEDICAMENTS COMPRISING THEM AND THEIR USE AVPR2, AVPR1B, AVPR1A KDM4E 4508/4885PKM 1171/4885GPR119 830/4885

“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.