SCHEMBL8233191

SCHEMBL8233191

Cc1ccc(CCNC(=O)Cn2nc(-c3ccccc3Cl)n(C3CC3)c2=O)cc1C

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.51
POLB P06746 2/20 0.43
MAPK1 P28482 1/20 0.40
KMT2A Q03164 1/20 0.40
OXTR P30559 1/20 0.39
MAPT P10636 1/20 0.39
TP53 P04637 2/20 0.38
GPR139 Q6DWJ6 3/20 0.38
CNR1 P21554 1/20 0.38
CHRNA7 P36544 1/20 0.38
HTT P42858 1/20 0.38
TRPA1 O75762 2/20 0.38

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
SCHEMBL8235910 0.90 LMNA (0.49) LMNAPOLBMAPK1KMT2AOXTR
SCHEMBL8227893 0.86 CNR1 (0.46) LMNAPOLBKMT2AMAPTTP53
SCHEMBL8235911 0.85 LMNA (0.48) LMNAKMT2ATP53GPR139CNR1
SCHEMBL8233136 0.82 KMT2A (0.47) LMNAPOLBKMT2AMAPTTP53
SCHEMBL8227808 0.80 TP53 (0.47) LMNAPOLBKMT2AMAPTTP53
SCHEMBL8233500 0.78 LMNA (0.42) LMNAPOLBMAPK1KMT2AMAPT
SCHEMBL4508631 0.78 LMNA (0.48) LMNAPOLBMAPK1KMT2AMAPT
SCHEMBL8235316 0.78 CNR1 (0.49) LMNAPOLBMAPK1KMT2ATP53
SCHEMBL8232810 0.78 AVPR2 (0.41) LMNAKMT2ACNR1
SCHEMBL8235921 0.77 MAPT (0.46) LMNAKMT2AMAPTTP53GPR139

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130005704-A1 SUBSTITUTED ARYLIMIDAZOLONE AND TRIAZOLONE AS INHIBITORS OF VASOPRESSIN RECEPTORS BAYER PHARMA AKTIENGESELLSHAFT (DE) 2013-01-03 US disclosed
EP-2027096-B1 SUBSTITUTED ARYLIMIDAZ0L0NE AND TRIAZ0L0NE AS INHIBITORS OF VASOPRESSIN RECEPTORS Bayer Pharma AG (DE) 2012-05-23 EP disclosed
US-8084481-B2 Substituted arylimidazolone and triazolone as inhibitors of vasopressin receptors BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2011-12-27 US disclosed
US-8084481-B2 Substituted arylimidazolone and triazolone as inhibitors of vasopressin receptors BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2011-12-27 US disclosed
US-20090312381-A1 Substituted Arylimidazolone and Triazolone as Inhibitors of Vasopressin Receptors BAYER HEALTHCARE AG (DE) 2009-12-17 US disclosed
US-20090312381-A1 Substituted Arylimidazolone and Triazolone as Inhibitors of Vasopressin Receptors BAYER HEALTHCARE AG (DE) 2009-12-17 US disclosed
WO-2007134862-A1 SUBSTITUTED ARYLIMIDAZ0L0NE AND TRIAZ0L0NE AS INHIBITORS OF VASOPRESSIN RECEPTORS BAYER HEALTHCARE AG (DE) 2007-11-29 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-20090312381-A1 Substituted Arylimidazolone and Triazolone as Inhibitors of Vasopressin Receptors AVPR2, AVPR1A, AVPR1B LMNA 2681/4885POLB 4652/4885MAPK1 1068/4885
US-20130005704-A1 SUBSTITUTED ARYLIMIDAZOLONE AND TRIAZOLONE AS INHIBITORS OF VASOPRESSIN RECEPTORS AVPR2, AVPR1A, AVPR1B LMNA 2681/4885POLB 4652/4885MAPK1 1068/4885

“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.