SCHEMBL7063180

SCHEMBL7063180

FC1(F)Oc2cc3nc(Br)[nH]c3cc2OC1(F)F

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 7/20 0.34
ATP4A P20648 5/20 0.34
ATP4B P51164 5/20 0.34
CSNK1G3 Q9Y6M4 1/20 0.34
NPY5R Q15761 1/20 0.34
ATP1A1 P05023 1/20 0.32
ATP1B1 P05026 1/20 0.32
ATP1A3 P13637 1/20 0.32
ATP1B2 P14415 1/20 0.32
ATP1A2 P50993 1/20 0.32
ATP1B3 P54709 1/20 0.32
FXYD2 P54710 1/20 0.32
ATP1A4 Q13733 1/20 0.32

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
SCHEMBL8043985 0.79 ATP4A (0.36) CSNK1EATP4AATP4BCSNK1G3NPY5R
SCHEMBL10626657 0.77 KDM4E (0.51) CSNK1ECSNK1G3
SCHEMBL6994892 0.76 PSMB8 (0.46) CSNK1EATP4AATP4BCSNK1G3NPY5R
SCHEMBL8560478 0.70 CSNK1E (0.38) CSNK1EATP4AATP4BCSNK1G3NPY5R
SCHEMBL9688607 0.70 CSNK1E (0.32) CSNK1EATP4AATP4BCSNK1G3NPY5R
SCHEMBL8306086 0.69 CSNK1E (0.42) CSNK1EATP4AATP4BCSNK1G3NPY5R
SCHEMBL15553070 0.69 FABP6 (0.49) CSNK1EATP4AATP4BCSNK1G3NPY5R
SCHEMBL8265318 0.69 MAPT (0.46) CSNK1EATP4AATP4BCSNK1G3NPY5R
SCHEMBL15825576 0.69 AMY1A (0.33)
SCHEMBL6992005 0.68 MAPT (0.46)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6638960-B2 Use as microbicides, especially fungicides, in crop protection BAYER AKTIENGESELLSCHAFT (DE) 2003-10-28 US disclosed
US-20030027842-A1 Halogenobenzimidazoles ASSMANN LUTZ (DE) 2003-02-06 US disclosed
US-6387939-B1 PLANT SAFENING AGNETS; FUNGICIDE BAYER AKTIENGESELLSCHAFT (DE) 2002-05-14 US disclosed
US-6268508-B1 FOR CROP PROTECTION BAYER AKTIENGESELLSCHAFT (DE) 2001-07-31 US disclosed
US-6160001-A Halobenzimidazoles and their use as microbicides BAYER AKTIENGESELLSCHAFT (DE) 2000-12-12 US disclosed
US-6127547-A FOR CROP PROTECTION; SUCH AS 2-BROMO-6,6-DIFLUORO(1,3)DIOXOLO(4,5-F)BENZIMIDAZOLE BAYER AKTIENGESELLSCHAFT (DE) 2000-10-03 US disclosed
US-6020354-A FUNGICIDES, BACTERICIDES BAYER AKTIENGESELLSCHAFT (DE) 2000-02-01 US disclosed
EP-0844998-A1 HALOBENZIMIDAZOLES AND THEIR USE AS MICROBICIDES BAYER AG (DE) 1998-06-03 EP disclosed
WO-1997006171-A1 HALOBENZIMIDAZOLES AND THEIR USE AS MICROBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-02-20 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-20030027842-A1 Halogenobenzimidazoles MSR1, MRPS23, CBR1 CSNK1E 378/4885ATP4A 1336/4885ATP4B 1012/4885

“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.