SCHEMBL8233149

SCHEMBL8233149

CCn1c(-c2ccc(OC)cc2)nn(CC(=O)NCc2cccc(C(F)(F)F)c2)c1=O

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.53
POLB P06746 1/20 0.53
AVPR2 P30518 5/20 0.49
AVPR1A P37288 5/20 0.49
TP53 P04637 3/20 0.49
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
ALDH1A1 P00352 1/20 0.46
SCD O00767 4/20 0.45
PPARG P37231 1/20 0.44
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 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
SCHEMBL4499208 0.90 AVPR2 (0.56) USP2POLBAVPR2AVPR1ATP53
SCHEMBL8233415 0.90 AVPR2 (0.60) POLBAVPR2AVPR1ATP53KMT2A
SCHEMBL8235008 0.86 SMN1; SMN2 (0.55) TP53KMT2ATDP1LMNAHTT
SCHEMBL8233206 0.86 TP53 (0.60) USP2POLBAVPR2AVPR1ATP53
SCHEMBL4502280 0.82 AVPR2 (0.56) AVPR2AVPR1ATP53KMT2ATDP1
SCHEMBL8235559 0.82 AVPR2 (0.62) AVPR2AVPR1ATP53KMT2ATDP1
SCHEMBL8237253 0.82 AVPR2 (0.59) POLBAVPR2AVPR1ATP53KMT2A
SCHEMBL8237169 0.81 AVPR2 (0.54) POLBAVPR2AVPR1ATP53
SCHEMBL3977250 0.81 AVPR2 (0.60) POLBAVPR2AVPR1ATP53KMT2A
SCHEMBL8233138 0.80 TP53 (0.54) AVPR2AVPR1ATP53

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
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 (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-20090312381-A1 Substituted Arylimidazolone and Triazolone as Inhibitors of Vasopressin Receptors AVPR2, AVPR1A, AVPR1B USP2 2925/4885POLB 4652/4885AVPR2 1/4885

“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.