SCHEMBL14973309

SCHEMBL14973309

CNNC(=O)c1cnn(C)c1CCc1ccc(C(F)(F)F)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.43
FLT1 P17948 3/20 0.41
KDR P35968 3/20 0.41
PDE2A O00408 2/20 0.40
FTO Q9C0B1 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
NR3C2 P08235 1/20 0.37
HDAC1 Q13547 2/20 0.37
HDAC8 Q9BY41 1/20 0.37
NR3C1 P04150 1/20 0.37
LSS P48449 1/20 0.37
HDAC3 O15379 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36

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
SCHEMBL14973035 0.84 ASPH (0.42) MAPTFLT1KDRPDE2AKDM4E
SCHEMBL14973107 0.83 KDM4E (0.43) MAPTFLT1KDRPDE2AKDM4E
SCHEMBL14973190 0.83 SLC6A5 (0.43) MAPTALDH1A1
SCHEMBL14973162 0.82 MEN1 (0.46) MAPT
Hydrochloric Acid SCHEMBL14973129 0.82 SLC6A5 (0.42) MAPTALDH1A1
SCHEMBL14973069 0.81 PDE2A (0.41) MAPTFLT1KDRPDE2ANR3C2
SCHEMBL14973210 0.79 MAPT (0.50) MAPTKDM4EALDH1A1
SCHEMBL14973308 0.79 PDE2A (0.38) MAPTFLT1KDRPDE2ANR3C2
SCHEMBL14973113 0.79 PTGS2 (0.41) MAPTALDH1A1
SCHEMBL14973071 0.76 PDE2A (0.39) MAPTFLT1KDRPDE2ANR3C2

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 MAPT 129/4885FLT1 4816/4885KDR 4760/4885

“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.