SCHEMBL8233155

SCHEMBL8233155

CCn1c(-c2ccc(Cl)cc2)n[nH]c1=O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APOBEC3G Q9HC16 6/20 0.68
GFER P55789 2/20 0.68
LMNA P02545 1/20 0.68
TDP1 Q9NUW8 1/20 0.68
CA9 Q16790 2/20 0.50
ALDH1A1 P00352 4/20 0.48
HPGD P15428 3/20 0.48
MAPT P10636 2/20 0.48
NPSR1 Q6W5P4 1/20 0.48
KDM4E B2RXH2 3/20 0.48
MEN1 O00255 1/20 0.48
TSHR P16473 1/20 0.48
KMT2A Q03164 1/20 0.48
POLB P06746 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HSD17B10 Q99714 1/20 0.47
PKM P14618 1/20 0.42
PGR P06401 1/20 0.42
IKBKB O14920 1/20 0.41

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
SCHEMBL8233143 0.84 ALDH1A1 (0.58) APOBEC3GGFERLMNATDP1CA9
SCHEMBL25271059 0.83 ALDH1A1 (0.47) APOBEC3GGFERLMNATDP1ALDH1A1
SCHEMBL8227328 0.83 APOBEC3G (0.51) APOBEC3GGFERLMNATDP1CA9
SCHEMBL8738538 0.83 APOBEC3G (0.51) APOBEC3GGFERLMNATDP1CA9
SCHEMBL3986959 0.83 GAA (0.54) APOBEC3GGFERLMNATDP1ALDH1A1
SCHEMBL4270680 0.81 APOBEC3G (0.61) APOBEC3GGFERLMNATDP1CA9
SCHEMBL8978563 0.81 APOBEC3G (1.00) APOBEC3GGFERLMNATDP1CA9
SCHEMBL9354368 0.80 ALDH1A1 (0.70) APOBEC3GGFERLMNATDP1ALDH1A1
SCHEMBL166328 0.80 MAPT (0.48) APOBEC3GGFERLMNATDP1CA9
SCHEMBL8232792 0.80 APOBEC3G (0.48) APOBEC3GGFERLMNATDP1CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5436252-A Antiischemic agents, stroke, Alzheimer's or Parkinson's diseases MERRELL DOW PHARMACEUTICALS INC. (US) 1995-07-25 US claimed
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
US-5436252-A Antiischemic agents, stroke, Alzheimer's or Parkinson's diseases MERRELL DOW PHARMACEUTICALS INC. (US) 1995-07-25 US disclosed
EP-0273310-B1 5-Aryl-3H-1,2,4-triazol-3-ones and their use as anticonvulsants MERRELL DOW PHARMA (US) 1995-06-21 EP disclosed
US-5391561-A Microbiocides ROHM AND HAAS COMPANY (US) 1995-02-21 US disclosed
EP-0273309-B1 5-Aryl-3H-1,2,4-triazol-3-ones and their use in the treatment of neurodegenerative disorders MERRELL DOW PHARMA (US) 1995-01-11 EP disclosed
EP-0404498-B1 Novel halo propargyl compounds, and uses and processes of preparation thereof ROHM & HAAS (US) 1994-10-19 EP disclosed
US-5292762-A Halopropargyl compounds, compositions, uses and processes of preparation ROHM AND HAAS COMPANY (US) 1994-03-08 US disclosed
US-5064845-A Heterocyclic iodopropargly compounds ROHM AND HAAS COMPANY (US) 1991-11-12 US disclosed
EP-0404498-A2 Novel halo propargyl compounds, and uses and processes of preparation thereof ROHM AND HAAS COMPANY (US) 1990-12-27 EP disclosed
US-4946856-A 5-phenyl-3H-1,2,4-triazol-3-ones and their use as anticonvulsants MERRELL DOW PHARMACEUTICALS INC. (US) 1990-08-07 US disclosed
EP-0273309-A2 5-Aryl-3H-1,2,4-triazol-3-ones and their use in the treatment of neurodegenerative disorders MERRELL DOW PHARMACEUTICALS INC. (US) 1988-07-06 EP 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 APOBEC3G 3518/4885GFER 2439/4885LMNA 2681/4885
US-20130005704-A1 SUBSTITUTED ARYLIMIDAZOLONE AND TRIAZOLONE AS INHIBITORS OF VASOPRESSIN RECEPTORS AVPR2, AVPR1A, AVPR1B APOBEC3G 3518/4885GFER 2439/4885LMNA 2681/4885

“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.