SCHEMBL23486276

SCHEMBL23486276

COC(=O)c1nnccc1NCc1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.46
▸ F2 P00734 1/20 0.43
▸ TSHR P16473 1/20 0.41
▸ KCNQ3 O43525 3/20 0.41
▸ KCNQ2 O43526 3/20 0.41
▸ RPS6KB1 P23443 1/20 0.41
▸ GAA P10253 1/20 0.40
▸ KDM5B Q9UGL1 1/20 0.40
▸ MAPK1 P28482 2/20 0.40
▸ ABCB11 O95342 1/20 0.40
▸ ESR1 P03372 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ HTR1A P08908 1/20 0.40
▸ ADRA2A P08913 1/20 0.40
▸ ADORA3 P0DMS8 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ NFKB1 P19838 1/20 0.40

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
SCHEMBL22609297 0.85 P4HTM (0.48) F2RPS6KB1KDM5BCYP1A2CYP2C19
SCHEMBL15529175 0.76 MAPT (0.57) MAPTF2TSHRRPS6KB1GAA
SCHEMBL15839871 0.74 KDM4C (0.56) MAPTTSHRGAAKDM5BHSD17B10
SCHEMBL1715126 0.72 MAPT (0.60) MAPTTSHRGAACYP1A2CYP2D6
SCHEMBL23486593 0.72 KDM4C (0.56) MAPTTSHRRPS6KB1CYP1A2CYP3A4
SCHEMBL6103736 0.71 KDM5B (0.76) MAPTRPS6KB1KDM5BCYP1A2CYP2C19
SCHEMBL22609263 0.70 LMNA (0.50) MAPTGAAMAPK1NFKB1SMN1; SMN2
SCHEMBL22609276 0.70 ALDH1A1 (0.53) MAPTTSHRKCNQ3KCNQ2VNN1
SCHEMBL13906984 0.70 TDP1 (0.38) MAPTKCNQ3KCNQ2MAPK1ALOX15
SCHEMBL31716167 0.69 HDAC8 (0.54) MAPTKCNQ3KCNQ2MAPK1CYP2C9

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-20210171503-A1 GLYCOLATE OXIDASE INHIBITORS AND USE THEREOF ORFAN BIOTECH SL (ES) 2021-06-10 — — 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-20210171503-A1 GLYCOLATE OXIDASE INHIBITORS AND USE THEREOF PNPO, XDH, GLS MAPT 2376/4885F2 770/4885TSHR 1767/4885

“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.

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