SCHEMBL8233185

SCHEMBL8233185

O=C(Cn1nc(-c2ccc(Cl)cc2)n(C2CC2)c1=O)NCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.48
HPGD P15428 1/20 0.48
MAPT P10636 2/20 0.47
GPR139 Q6DWJ6 1/20 0.47
THRB P10828 1/20 0.46
AVPR2 P30518 2/20 0.45
AVPR1A P37288 2/20 0.45
MAPK1 P28482 1/20 0.45
TSHR P16473 2/20 0.44
TP53 P04637 1/20 0.44
LMNA P02545 2/20 0.44
POLB P06746 1/20 0.44
USP2 O75604 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
NPC1 O15118 1/20 0.43

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
SCHEMBL8233424 0.96 HPGD (0.49) CNR1HPGDMAPTGPR139THRB
SCHEMBL8232856 0.93 TP53 (0.47) CNR1HPGDMAPTTHRBAVPR2
SCHEMBL8227821 0.90 LMNA (0.51) MAPTGPR139AVPR2AVPR1AMAPK1
SCHEMBL8233097 0.89 TP53 (0.54) CNR1MAPTTHRBAVPR2AVPR1A
SCHEMBL8234723 0.89 KDM4E (0.53) MAPTTSHRLMNAPOLB
SCHEMBL8232498 0.89 CNR1 (0.52) CNR1MAPTTHRBAVPR2AVPR1A
SCHEMBL8235322 0.88 AVPR2 (0.43) MAPTGPR139THRBAVPR2AVPR1A
SCHEMBL8232483 0.88 ADAMTS4 (0.41) CNR1HPGDMAPTAVPR2AVPR1A
SCHEMBL8235328 0.88 AVPR2 (0.49) CNR1MAPTGPR139THRBAVPR2
SCHEMBL8234720 0.87 LMNA (0.53) HPGDMAPTGPR139AVPR2AVPR1A

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 CNR1 282/4885HPGD 334/4885MAPT 4794/4885
US-20130005704-A1 SUBSTITUTED ARYLIMIDAZOLONE AND TRIAZOLONE AS INHIBITORS OF VASOPRESSIN RECEPTORS AVPR2, AVPR1A, AVPR1B CNR1 282/4885HPGD 334/4885MAPT 4794/4885

“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.