SCHEMBL6839059

SCHEMBL6839059

C#CCO/N=C(C(/C)=N/OCc1ccccc1/C(=C\OC)C(=O)OC)\c1ccc(F)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.34
HIF1A Q16665 4/20 0.33
RAB9A P51151 2/20 0.32
GAA P10253 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
BCHE P06276 1/20 0.32
PLA2G1B P04054 1/20 0.32
ATG4B Q9Y4P1 1/20 0.32
NPC1 O15118 1/20 0.31
POLB P06746 1/20 0.31
KMT2A Q03164 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
SCHEMBL7743204 0.93 MAOB (0.39) HIF1APLA2G1BATG4BKMT2A
SCHEMBL7743200 0.93 MAOB (0.39) HIF1APLA2G1BATG4BKMT2A
SCHEMBL6841787 0.93 PTGS2 (0.38) PTGS2HIF1ASMN1; SMN2NPC1
SCHEMBL8711326 0.93 PTGS2 (0.38) PTGS2HIF1ASMN1; SMN2NPC1
SCHEMBL17949973 0.89 HIF1A (0.42) HIF1ARAB9AGAASMN1; SMN2CYP1A2
SCHEMBL8725188 0.83 HIF1A (0.40) PTGS2HIF1A
SCHEMBL8725191 0.83 HIF1A (0.40) PTGS2HIF1A
SCHEMBL7863544 0.83 HIF1A (0.40) PTGS2HIF1A
SCHEMBL7736847 0.83 MAOB (0.45) HIF1A
SCHEMBL6841529 0.83 MAOB (0.45) HIF1A

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-20040039220-A1 Process for the preparation of pesticides FAROOQ SALEEM (CH) 2004-02-26 US disclosed
EP-0876333-B1 PROCESS FOR THE PREPARATION OF PESTICIDES BAYER AG (DE) 2002-03-27 EP disclosed
US-6156923-A Process for the preparation of pesticides NOVARTIS CORPORATION (US) 2000-12-05 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-20040039220-A1 Process for the preparation of pesticides CHRM1, CHRM2, F7 PTGS2 604/4885HIF1A 3590/4885RAB9A 984/4885

“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.