SCHEMBL14973308

SCHEMBL14973308

CN(N)C(=O)c1cnn(C)c1CCc1ccc(C(F)(F)F)cc1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 2/20 0.38
NR3C2 P08235 1/20 0.37
HDAC1 Q13547 2/20 0.37
HDAC6 Q9UBN7 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
FLT1 P17948 2/20 0.36
KDR P35968 2/20 0.36
MAPT P10636 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
LSS P48449 1/20 0.34

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
SCHEMBL14973107 0.85 KDM4E (0.43) PDE2ANR3C2HDAC1HDAC8FLT1
SCHEMBL14973035 0.84 ASPH (0.42) PDE2ANR3C2HDAC1HDAC8FLT1
SCHEMBL14973189 0.82 MAOB (0.42) MAPT
SCHEMBL14973210 0.79 MAPT (0.50) MAPTHSP90AA1
SCHEMBL14973309 0.79 MAPT (0.43) PDE2ANR3C2HDAC1HDAC6HDAC8
SCHEMBL14973071 0.79 PDE2A (0.39) PDE2ANR3C2FLT1KDRMAPT
SCHEMBL14973069 0.79 PDE2A (0.41) PDE2ANR3C2HDAC1HDAC6HDAC8
SCHEMBL14973162 0.74 MEN1 (0.46) MAPT
SCHEMBL14937979 0.73 PDE2A (0.44) PDE2AFLT1KDRTAAR1
SCHEMBL14973113 0.71 PTGS2 (0.41) MAPT

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-2604602-A1 HETEROARYL-PYRAZOLE DERIVATIVE Taisho Pharmaceutical Co., Ltd. (JP) 2013-06-19 EP disclosed
US-20130137865-A1 HETEROARYL-PYRAZOLE DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD. (JP) 2013-05-30 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-20130137865-A1 HETEROARYL-PYRAZOLE DERIVATIVE GRIN2C, GRIN2B, GRIN3A PDE2A 2129/4885NR3C2 83/4885HDAC1 239/4885

“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.