SCHEMBL14496352

SCHEMBL14496352

O=C(CNc1ccc(C(F)(F)F)cc1)N/N=C/c1ccncc1

nearest known ligand 0.77

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GRK2 P25098 16/20 0.77
▸ ROCK2 O75116 4/20 0.73
▸ GAA P10253 1/20 0.73
▸ GRK3 P35626 4/20 0.64
▸ MEN1 O00255 1/20 0.64
▸ KMT2A Q03164 1/20 0.64
▸ GRK5 P34947 1/20 0.60

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
SCHEMBL14496349 0.87 GRK2 (1.00) GRK2ROCK2GRK3GRK5
SCHEMBL14496351 0.87 GRK2 (1.00) GRK2ROCK2GAAGRK3MEN1
SCHEMBL14496358 0.85 GRK2 (1.00) GRK2ROCK2GAAGRK3MEN1
SCHEMBL14496356 0.85 GAA (1.00) GRK2ROCK2GAAGRK3MEN1
SCHEMBL14496331 0.85 GRK2 (1.00) GRK2ROCK2GAAGRK3MEN1
SCHEMBL14496390 0.85 GRK2 (0.77) GRK2ROCK2GAAGRK3MEN1
SCHEMBL14496270 0.84 GRK2 (1.00) GRK2ROCK2GAAGRK3MEN1
SCHEMBL14496401 0.84 GRK2 (0.75) GRK2ROCK2GAAGRK3MEN1
SCHEMBL14496366 0.81 GRK2 (1.00) GRK2ROCK2GAAGRK3MEN1
SCHEMBL1670013 0.81 MAPT (0.58) GRK2ROCK2GAAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070135499-A1 Hydrazide compounds AERIE PHARMACEUTICALS, INC. (US) 2007-06-14 — — US disclosed
US-20070135499-A1 Hydrazide compounds AERIE PHARMACEUTICALS, INC. (US) 2007-06-14 — — US disclosed
WO-2007008942-A2 PHENYLAMINO-ACETIC ACID [1-(PYRIDIN-4-YL)-METHYLIDENE]-HYDRAZIDE DERIVATIVES AND RELATED COMPOUNDS AS MODULATORS OF G PROTEIN-COUPLED RECEPTOR KINASES FOR THE TREATMENT OF EYE DISEASES AERIE PHARMACEUTICALS, INC. (US) 2007-01-18 — — WO 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-20070135499-A1 Hydrazide compounds GRK4, GRK2, GRK1 GRK2 2/4885ROCK2 757/4885GAA 997/4885

“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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