SCHEMBL6809974

SCHEMBL6809974

FC(F)(F)CCNc1cc(-c2ccccc2)nn1CCOc1ccc2cc(Br)ccc2c1Br

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.35
LMNA P02545 3/20 0.35
RXFP1 Q9HBX9 2/20 0.35
PRNP P04156 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
KMT2A Q03164 6/20 0.34
MEN1 O00255 5/20 0.34
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
GAA P10253 2/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MAPK1 P28482 2/20 0.33
POLB P06746 1/20 0.33
PKM P14618 1/20 0.32
NCEH1 Q6PIU2 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
SCHEMBL6805483 0.91 KMT2A (0.36) MAPTLMNARXFP1PRNPTDP1
SCHEMBL6605026 0.87 RXFP1 (0.37) MAPTLMNARXFP1PRNPTDP1
SCHEMBL6602237 0.81 MAPT (0.47) MAPTLMNARXFP1PRNPTDP1
SCHEMBL6607152 0.80 MAPT (0.46) MAPTLMNARXFP1PRNPTDP1
SCHEMBL6602671 0.78 RXFP1 (0.39) MAPTLMNARXFP1PRNPTDP1
SCHEMBL6602524 0.77 ADORA1 (0.40) MAPTLMNARXFP1PRNPTDP1
SCHEMBL6607900 0.77 RXFP1 (0.38) MAPTLMNARXFP1PRNPTDP1
SCHEMBL6601377 0.76 RXFP1 (0.39) MAPTLMNARXFP1PRNPTDP1
SCHEMBL6803979 0.76 MAPT (0.37) MAPTLMNARXFP1PRNPTDP1
SCHEMBL6603868 0.72 KMT2A (0.35) MAPTLMNARXFP1PRNPTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040180891-A1 Pyrazole derivatives useful in the treatment of hyper-proliferative disorders BAYER PHARMACEUTICALS CORPORATION 2004-09-16 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-20040180891-A1 Pyrazole derivatives useful in the treatment of hyper-proliferative disorders MKI67, CDK4, FLT4 MAPT 3013/4885LMNA 4637/4885RXFP1 3332/4885

“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.