SCHEMBL31429973

SCHEMBL31429973

FC(F)(F)c1ccc(C=NNc2ccccc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.69
RAB9A P51151 8/20 0.69
KMT2A Q03164 8/20 0.69
MEN1 O00255 7/20 0.69
SMN1; SMN2 Q16637 7/20 0.69
NPC1 O15118 6/20 0.69
NOX1 Q9Y5S8 2/20 0.67
GAA P10253 8/20 0.62
ALDH1A1 P00352 3/20 0.62
PKM P14618 1/20 0.62
NFKB1 P19838 1/20 0.62
NFKB2 Q00653 1/20 0.62
RELA Q04206 1/20 0.62
ATM Q13315 1/20 0.62
HPGD P15428 3/20 0.62
LMNA P02545 2/20 0.62
POLB P06746 1/20 0.58
CRHBP P24387 1/20 0.58
HTT P42858 1/20 0.58
CRHR2 Q13324 1/20 0.58

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
SCHEMBL11388177 0.85 NOX1 (0.91) MAPTRAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL11388174 0.85 NOX1 (0.91) MAPTRAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL1164826 0.83 MAPT (0.63) MAPTRAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL1164827 0.83 MAPT (0.63) MAPTRAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL7863736 0.83 MAPT (0.68) MAPTRAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL7863738 0.83 MAPT (0.68) MAPTRAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL14839363 0.81 RAB9A (0.64) MAPTRAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL22874080 0.81 NOX1 (1.00) MAPTRAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL42160 0.81 NOX1 (1.00) MAPTRAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL42159 0.81 NOX1 (1.00) MAPTRAB9AKMT2AMEN1SMN1; SMN2

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-20260009142-A1 Electrochemical synthesis of pyrazolines and pyrazoles BAYER AG (DE) 2026-01-08 US disclosed
CN-119698496-A Electrochemical synthesis of pyrazolines and pyrazoles 拜耳公司 2025-03-25 CN 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-20260009142-A1 Electrochemical synthesis of pyrazolines and pyrazoles CYP2E1, CYP2F1, CYP4F2 MAPT 4836/4885RAB9A 4644/4885KMT2A 3774/4885

“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.