SCHEMBL8375498

SCHEMBL8375498

CC1([O])C=Cc2ccccc21

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OXTR P30559 1/20 0.36
KDM4E B2RXH2 1/20 0.33
PKM P14618 1/20 0.33
PDK2 Q15119 1/20 0.33
PDK4 Q16654 1/20 0.33
HSD11B1 P28845 1/20 0.31

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
SCHEMBL251287 0.76 KDM4E (0.39) OXTRKDM4EPKMPDK2PDK4
SCHEMBL29387054 0.76 KDM4E (0.39) OXTRKDM4EPKMPDK2PDK4
SCHEMBL27414073 0.74 KDM4E (0.38) OXTRKDM4EPKMPDK2PDK4
SCHEMBL28056042 0.74 KDM4E (0.38) OXTRKDM4EPKMPDK2PDK4
Ammonia Solution, Strong SCHEMBL7086115 0.74 KDM4E (0.38) OXTRKDM4EPKMPDK2PDK4
Hydrochloric Acid SCHEMBL8675870 0.73 OXTR (0.33) OXTRKDM4EPKM
SCHEMBL8861340 0.73 OXTR (0.33) OXTRKDM4EPKM
SCHEMBL8737325 0.73 OXTR (0.33) OXTRKDM4EPKMHSD11B1
SCHEMBL5090884 0.73 OXTR (0.33) OXTRKDM4EPKM
SCHEMBL5574452 0.73 KDM4E (0.37) OXTRKDM4EPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10451967-B2 Acid- and radical-generating agent and method for generating acid and radical FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2019-10-22 US disclosed
US-20160342084-A1 ACID- AND RADICAL-GENERATING AGENT AND METHOD FOR GENERATING ACID AND RADICAL FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2016-11-24 US disclosed
US-6005116-A HAVE INHIBITION ACTIVITIES AGAINST TYPE A-MONOAMINE OXIDASE; TREATING OR PREVENTING DEPRESSION, PARKINSON'S DISEASE, ALZEHEIMER'S DEMENTIA, OR CEREBROVASCULAR DEMENTIA SANKYO COMPANY, LIMITED (JP) 1999-12-21 US disclosed
EP-0885891-A1 ISOXAZOLE DERIVATIVES SANKYO COMPANY LIMITED (JP) 1998-12-23 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-10451967-B2 Acid- and radical-generating agent and method for generating acid and radical CBR1, HAO2, CBR3 OXTR 2394/4885KDM4E 4342/4885PKM 1991/4885
US-20160342084-A1 ACID- AND RADICAL-GENERATING AGENT AND METHOD FOR GENERATING ACID AND RADICAL CBR1, HAO2, CBR3 OXTR 2394/4885KDM4E 4342/4885PKM 1991/4885

“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.