SCHEMBL14973102

SCHEMBL14973102

Cn1ncc(C(=N)NO)c1COc1ccc(C(F)(F)F)cc1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HMOX1 P09601 1/20 0.38
MAOB P27338 5/20 0.38
ALDH1A1 P00352 1/20 0.38
NOS1 P29475 4/20 0.38
FLT3 P36888 1/20 0.37
SLC6A5 Q9Y345 1/20 0.37
SMPD1 P17405 1/20 0.36
KDM4C Q9H3R0 1/20 0.36
GRM4 Q14833 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
SCHEMBL14973190 0.83 SLC6A5 (0.43) MAOBALDH1A1FLT3SLC6A5KDM4C
SCHEMBL14972954 0.82 KDM4C (0.47) MAOBALDH1A1FLT3SLC6A5KDM4C
SCHEMBL14972951 0.82 MAOB (0.52) MAOBALDH1A1FLT3SLC6A5KDM4C
Hydrochloric Acid SCHEMBL14973129 0.82 SLC6A5 (0.42) MAOBALDH1A1FLT3SLC6A5KDM4C
SCHEMBL14972953 0.81 ALDH1A1 (0.52) MAOBALDH1A1FLT3SLC6A5GRM4
SCHEMBL14973069 0.81 PDE2A (0.41)
SCHEMBL14973018 0.80 MAOB (0.44) MAOBALDH1A1FLT3SLC6A5KDM4C
SCHEMBL14973189 0.80 MAOB (0.42) MAOBALDH1A1FLT3SLC6A5GRM4
SCHEMBL14973105 0.79 MAPT (0.41) HMOX1MAOBALDH1A1NOS1FLT3
SCHEMBL14972952 0.78 MAPT (0.52) MAOBALDH1A1

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 HMOX1 1981/4885MAOB 1115/4885ALDH1A1 2263/4885

“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.