SCHEMBL4782032

SCHEMBL4782032

Cc1cc(Oc2c(C3CC3)nn(C3CCS(=O)(=O)C3)c2C)cc(C)c1C#N

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.36
KCNJ6 P48051 15/20 0.34
KCNJ3 P48549 15/20 0.34
KCNJ5 P48544 11/20 0.33
MAPT P10636 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
PDE4A P27815 1/20 0.30
PDE4B Q07343 1/20 0.30
PDE4C Q08493 1/20 0.30
PDE4D Q08499 1/20 0.30

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
SCHEMBL4782054 0.96 L3MBTL1 (0.33) L3MBTL1KCNJ6KCNJ3KCNJ5MAPT
SCHEMBL4731703 0.93
SCHEMBL4781015 0.91 L3MBTL1 (0.35) L3MBTL1KCNJ6KCNJ3KCNJ5MAPT
SCHEMBL14221380 0.87 KCNJ6 (0.36) KCNJ6KCNJ3KCNJ5MAPTKDM4E
SCHEMBL4784718 0.85 KDM1A (0.30)
SCHEMBL4781499 0.84 L3MBTL1 (0.39) L3MBTL1KCNJ6KCNJ3KCNJ5MAPT
SCHEMBL4919594 0.84
SCHEMBL4784279 0.83 KDM1A (0.31)
SCHEMBL14221381 0.83 KCNJ6 (0.35) KCNJ6KCNJ3KCNJ5MAPTKDM4E
SCHEMBL4783839 0.80 L3MBTL1 (0.36) L3MBTL1KCNJ6KCNJ3KCNJ5MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080096950-A1 Compounds Useful In Therapy PFIZER INC. 2008-04-24 US claimed
US-20080096950-A1 Compounds Useful In Therapy PFIZER INC. 2008-04-24 US disclosed
US-20080096950-A1 Compounds Useful In Therapy PFIZER INC. 2008-04-24 US disclosed
WO-2008047224-A1 PYRAZOLYL-4-OXY-BENZONITRILE DERIVATIVES USEFUL IN TREATING ENDOMETRIOSIS PFIZER LIMITED (GB) 2008-04-24 WO disclosed
US-20080096950-A1 Compounds Useful In Therapy PFIZER INC. 2008-04-24 US 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-20080096950-A1 Compounds Useful In Therapy CYP19A1, LPXN, HSD17B11 L3MBTL1 4303/4885KCNJ6 3322/4885KCNJ3 3442/4885

“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.