SCHEMBL3370161

SCHEMBL3370161

OC1Cc2ccccc2[C]N1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.32
MEN1 O00255 1/20 0.32
RECQL P46063 1/20 0.32
KMT2A Q03164 1/20 0.32
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
ANPEP P15144 1/20 0.31

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
SCHEMBL1828173 0.76 TSHR (0.42)
SCHEMBL4738898 0.76 TRPM5 (0.37)
SCHEMBL3374279 0.74 MAPT (0.53) CYP2D6MEN1KMT2AGAAMAPT
SCHEMBL3921328 0.71 MAPT (0.41) MEN1KMT2AGAAMAPT
SCHEMBL4161186 0.70 MAPT (0.37) MEN1KMT2AGAAMAPT
SCHEMBL1444986 0.69 IDO1 (0.41) ANPEP
SCHEMBL6962983 0.68 ANPEP (0.33) CYP2D6MEN1RECQLKMT2AANPEP
SCHEMBL4407901 0.68 ANPEP (0.33) CYP2D6MEN1RECQLKMT2AANPEP
SCHEMBL6141217 0.66 PNMT (0.35) CYP2D6MAPT
SCHEMBL9510934 0.65 ANPEP (0.39) ANPEP

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
US-20100324091-A1 Pyrazolone Derivative KOWA COMPANY, LTD. (JP) 2010-12-23 US disclosed
EP-2172458-A1 PYRAZOLONE DERIVATIVE Kowa Company, Ltd. (JP) 2010-04-07 EP 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-20100324091-A1 Pyrazolone Derivative SERPINE1, SERPINC1, TFPI CYP2D6 1265/4885MEN1 2985/4885RECQL 2623/4885

“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.