SCHEMBL908137

SCHEMBL908137

NC1=NN(c2cccc(Cl)c2)C(c2ccccc2)C1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PRKCZ Q05513 9/20 0.58
ATM Q13315 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
EGFR P00533 1/20 0.47
KIF11 P52732 1/20 0.46
PDE5A O76074 2/20 0.46
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45
CA1 P00915 1/20 0.44
CA2 P00918 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
SCHEMBL11068412 0.85 MEN1 (0.54) PRKCZATML3MBTL1EGFRPDE5A
SCHEMBL908494 0.84 CA1 (0.56) PRKCZL3MBTL1EGFRPDE5ACA1
SCHEMBL11060811 0.84 PRKCZ (0.56) PRKCZATMEGFRPDE5AMAOA
SCHEMBL11374953 0.83 PRKCZ (0.53) PRKCZATML3MBTL1EGFRMAOA
SCHEMBL11095289 0.83 PRKCZ (0.52) PRKCZATML3MBTL1EGFRPDE5A
SCHEMBL11089782 0.83 ABL1 (0.46) PRKCZATML3MBTL1EGFRPDE5A
SCHEMBL11068397 0.80 PRKCZ (0.52) PRKCZEGFRPDE5A
SCHEMBL11188275 0.80 PRKCZ (0.56) PRKCZL3MBTL1
SCHEMBL908054 0.79 PRKCZ (0.45) PRKCZ
SCHEMBL11104257 0.77 EGFR (0.57) PRKCZATML3MBTL1EGFRPDE5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110003862-A1 3-Animopyraolines for Treatment of Neurodegenerative and Psychiatric Diseases MERCK SHARP & DOHME LIMITED (GB) 2011-01-06 US claimed
EP-1987007-A1 3-AMINOPYRAZOLINES FOR TREATMENT OF NEURODEGENERATIVE AND PSYCHIATRIC DISEASES MERCK SHARP & DOHME LTD. (GB) 2008-11-05 EP claimed
WO-2007093829-A1 3-AMINOPYRAZOLINES FOR TREATMENT OF NEURODEGENERATIVE AND PSYCHIATRIC DISEASES MERCK SHARP & DOHME LIMITED (GB) 2007-08-23 WO claimed
US-4451479-A ANTIINFLAMMATORY AMERICAN CYANAMID COMPANY (US) 1984-05-29 US claimed
US-20110003862-A1 3-Animopyraolines for Treatment of Neurodegenerative and Psychiatric Diseases MERCK SHARP & DOHME LIMITED (GB) 2011-01-06 US disclosed
EP-1987007-A1 3-AMINOPYRAZOLINES FOR TREATMENT OF NEURODEGENERATIVE AND PSYCHIATRIC DISEASES MERCK SHARP & DOHME LTD. (GB) 2008-11-05 EP disclosed
WO-2007093829-A1 3-AMINOPYRAZOLINES FOR TREATMENT OF NEURODEGENERATIVE AND PSYCHIATRIC DISEASES MERCK SHARP & DOHME LIMITED (GB) 2007-08-23 WO disclosed
US-4451479-A ANTIINFLAMMATORY AMERICAN CYANAMID COMPANY (US) 1984-05-29 US disclosed
EP-0070376-A1 Heterocyclic substituted-amino-pyrazolines AMERICAN CYANAMID COMPANY (US) 1983-01-26 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 (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-20110003862-A1 3-Animopyraolines for Treatment of Neurodegenerative and Psychiatric Diseases DAO, DDO, MAOA PRKCZ 2127/4885ATM 797/4885L3MBTL1 2289/4885

“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.