SCHEMBL3464288

SCHEMBL3464288

COc1cc(C(Nc2ccc(C(=N)N)cc2)C(=O)NNc2ccccc2)cc(OC)c1OC(=O)C(F)(F)F

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F7 P08709 16/20 0.51
PRSS1 P07477 14/20 0.51
F2 P00734 14/20 0.51
F10 P00742 13/20 0.51
F3 P13726 8/20 0.50
PRSS2 P07478 6/20 0.50
PRSS3 P35030 6/20 0.50
MAPT P10636 3/20 0.41
ALDH1A1 P00352 2/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
ALOX12 P18054 1/20 0.41
MEN1 O00255 1/20 0.40
THRB P10828 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MRGPRX1 Q96LB2 1/20 0.38
KDM4E B2RXH2 1/20 0.37
PLAU P00749 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
SCHEMBL3463459 0.90 F7 (0.47) F7PRSS1F2F10F3
SCHEMBL3463400 0.88 F7 (0.47) F7PRSS1F2F10F3
Trifluoroacetic Acid SCHEMBL3464282 0.88 F7 (0.52) F7PRSS1F2F10F3
SCHEMBL3465095 0.87 F7 (0.56) F7PRSS1F2F10F3
SCHEMBL13161845 0.85 F7 (0.57) F7PRSS1F2F10F3
SCHEMBL3463006 0.83 F7 (0.63) F7PRSS1F2F10F3
SCHEMBL3464134 0.83 GAA (0.44) F7PRSS1F2F10F3
SCHEMBL3464526 0.82 F7 (0.44) F7PRSS1F2F10F3
Trifluoroacetic Acid SCHEMBL3463115 0.81 F7 (0.51) F7PRSS1F2F10F3
Trifluoroacetic Acid SCHEMBL3463887 0.81 F7 (0.49) F7PRSS1F2F10F3

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-20100240654-A1 HYDRAZIDE DERIVATIVES CLARK RICHARD 2010-09-23 US disclosed
US-20080132507-A1 Hydrazide Derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2008-06-05 US disclosed
EP-1810965-A1 HYDRAZIDE DERIVATIVES Eisai R&D Management Co., Ltd. (JP) 2007-07-25 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 (2 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-20100240654-A1 HYDRAZIDE DERIVATIVES H1-10, H1-4, H1-3 F7 185/4885PRSS1 727/4885F2 19/4885
US-20080132507-A1 Hydrazide Derivatives H1-10, H1-4, H1-3 F7 185/4885PRSS1 727/4885F2 19/4885

“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.