SCHEMBL3071642

SCHEMBL3071642

Cn1cc(C(=O)Nc2ccccc2OC(F)(F)C(F)F)c(C(F)Cl)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.48
MAPK1 P28482 1/20 0.48
ATM Q13315 1/20 0.42
ALDH1A1 P00352 3/20 0.42
KMT2A Q03164 6/20 0.40
MEN1 O00255 4/20 0.40
LMNA P02545 3/20 0.39
KDM4E B2RXH2 3/20 0.39
MAPT P10636 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
GAA P10253 2/20 0.39
HSP90AA1 P07900 1/20 0.39
NCOA1 Q15788 1/20 0.39
NCOA3 Q9Y6Q9 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PTBP1 P26599 1/20 0.39
HTT P42858 1/20 0.39
POLB P06746 1/20 0.39
DHODH Q02127 2/20 0.39

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
SCHEMBL68046 0.92 TSHR (0.49) TSHRMAPK1ATMALDH1A1KMT2A
SCHEMBL29419112 0.92 TSHR (0.49) TSHRMAPK1ATMALDH1A1KMT2A
SCHEMBL11962977 0.91 TSHR (0.46) TSHRMAPK1ATMALDH1A1KMT2A
SCHEMBL528778 0.89 TSHR (0.42) TSHRMAPK1ATMALDH1A1KMT2A
SCHEMBL29779370 0.89 TSHR (0.42) TSHRMAPK1ATMALDH1A1KMT2A
SCHEMBL29274932 0.86 LMNA (0.47) TSHRMAPK1ATMALDH1A1KMT2A
SCHEMBL3067877 0.86 ATM (0.59) TSHRMAPK1ATMALDH1A1KMT2A
SCHEMBL3062126 0.85 TSHR (0.48) TSHRMAPK1ATMALDH1A1KMT2A
SCHEMBL69473 0.85 LMNA (0.53) TSHRMAPK1ATMALDH1A1KMT2A
SCHEMBL29469563 0.85 LMNA (0.53) TSHRMAPK1ATMALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100222217-A1 Fungicidal N-[2-(Haloalkoxy)Phenyl]Heteroarylcarboxamides BASF AKTIENGESELLSCHAFT (DE) 2010-09-02 US claimed
US-20080255107-A1 Fungicidal Mixtures Comprising N-[2-(Haloalk(Enyl)Oxy)Phenyl]Carboxamides BASF SE (DE) 2008-10-16 US claimed
US-20100222217-A1 Fungicidal N-[2-(Haloalkoxy)Phenyl]Heteroarylcarboxamides BASF AKTIENGESELLSCHAFT (DE) 2010-09-02 US disclosed
US-20080255107-A1 Fungicidal Mixtures Comprising N-[2-(Haloalk(Enyl)Oxy)Phenyl]Carboxamides BASF SE (DE) 2008-10-16 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 (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-20080255107-A1 Fungicidal Mixtures Comprising N-[2-(Haloalk(Enyl)Oxy)Phenyl]Carboxamides CBR3, CBR1, NAT1 TSHR 2622/4885MAPK1 3525/4885ATM 4828/4885
US-20100222217-A1 Fungicidal N-[2-(Haloalkoxy)Phenyl]Heteroarylcarboxamides CBR3, HDHD5, CYP8B1 TSHR 1714/4885MAPK1 2297/4885ATM 4788/4885

“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.