SCHEMBL1961135

SCHEMBL1961135

CC(=O)Cc1cnc(-c2nn(-c3ccc(F)cc3)cc2Sc2ccc(Cl)cc2)cn1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.67
KCNH2 Q12809 3/20 0.67
KDM4E B2RXH2 2/20 0.34
DRD2 P14416 1/20 0.34
CDK2 P24941 3/20 0.33
MAPT P10636 2/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33
UBE2N P61088 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CCNE1 P24864 1/20 0.33
CA12 O43570 3/20 0.32
CA1 P00915 3/20 0.32
CA2 P00918 3/20 0.32
CA9 Q16790 3/20 0.32
PTGES O14684 1/20 0.32
RAB9A P51151 3/20 0.32
NPC1 O15118 2/20 0.32
LMNA P02545 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL12551879 0.86 FAAH (0.70) FAAHKCNH2CDK2MAPTPTGDR2
SCHEMBL1963544 0.86 FAAH (0.67) FAAHKCNH2KDM4ECDK2MAPT
SCHEMBL1961941 0.85 FAAH (0.64) FAAHKCNH2KDM4ECDK2MAPT
SCHEMBL1961136 0.83 FAAH (0.67) FAAHKCNH2KDM4ECDK2MAPT
SCHEMBL15016219 0.83 FAAH (0.68) FAAHKCNH2KDM4EDRD2CDK2
SCHEMBL8001300 0.82 FAAH (0.73) FAAHKCNH2KDM4ECDK2MAPT
SCHEMBL1535331 0.81 FAAH (0.67) FAAHKCNH2KDM4ECDK2MAPT
SCHEMBL12551892 0.80 FAAH (0.70) FAAHKCNH2CDK2MAPTUBE2N
SCHEMBL1959250 0.80 FAAH (1.00) FAAHKCNH2CDK2MAPTUBE2N
SCHEMBL8001298 0.78 FAAH (0.82) FAAHKCNH2CDK2CCNE1PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2299824-B1 PYRAZOLE DERIVATIVES USEFUL AS INHIBITORS OF FAAH MERCK SHARP & DOHME (US) 2013-06-19 EP disclosed
US-20110144056-A1 PYRAZOLE DERIVATIVES USEFUL AS INHIBITORS OF FAAH MERCK SHARP & DOHME CORP. 2011-06-16 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-20110144056-A1 PYRAZOLE DERIVATIVES USEFUL AS INHIBITORS OF FAAH FAAH, FAAH2, HRH2 FAAH 1/4885KCNH2 930/4885KDM4E 1303/4885

“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.