SCHEMBL14973190

SCHEMBL14973190

CNNC(=O)c1cnn(C)c1COc1ccc(C(F)(F)F)cc1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A5 Q9Y345 7/20 0.43
MAOB P27338 2/20 0.43
ALDH1A1 P00352 1/20 0.42
FLT3 P36888 1/20 0.41
MAPT P10636 1/20 0.40
KDM4C Q9H3R0 1/20 0.40
GRM4 Q14833 1/20 0.40
PPARD Q03181 2/20 0.39
PPARA Q07869 1/20 0.39
MCHR1 Q99705 1/20 0.39

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
Hydrochloric Acid SCHEMBL14973129 0.99 SLC6A5 (0.42) SLC6A5MAOBALDH1A1FLT3MAPT
SCHEMBL14972953 0.90 ALDH1A1 (0.52) SLC6A5MAOBALDH1A1FLT3MAPT
SCHEMBL14972954 0.86 KDM4C (0.47) SLC6A5MAOBALDH1A1FLT3KDM4C
SCHEMBL14972951 0.86 MAOB (0.52) SLC6A5MAOBALDH1A1FLT3MAPT
SCHEMBL14973018 0.84 MAOB (0.44) SLC6A5MAOBALDH1A1FLT3KDM4C
SCHEMBL14973345 0.83 CA12 (0.46) SLC6A5MAOBMAPT
SCHEMBL14973102 0.83 HMOX1 (0.38) SLC6A5MAOBALDH1A1FLT3KDM4C
SCHEMBL14973309 0.83 MAPT (0.43) ALDH1A1MAPT
SCHEMBL14972952 0.82 MAPT (0.52) MAOBALDH1A1MAPTPPARD
SCHEMBL14973189 0.81 MAOB (0.42) SLC6A5MAOBALDH1A1FLT3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 SLC6A5 124/4885MAOB 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.