SCHEMBL4447678

SCHEMBL4447678

Cn1cc(C(=O)Nc2ccccc2-c2ccc(Cl)cc2F)c(C(F)(F)F)n1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.60
POLB P06746 1/20 0.60
TMPRSS4 Q9NRS4 1/20 0.45
KCNMA1 Q12791 1/20 0.45
NTRK1 P04629 2/20 0.44
BACE1 P56817 3/20 0.43
BACE2 Q9Y5Z0 3/20 0.43
WDR5 P61964 1/20 0.42
KLKB1 P03952 1/20 0.42
GRM5 P41594 1/20 0.42
HSD11B1 P28845 1/20 0.42
JAK2 O60674 1/20 0.42
JAK1 P23458 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 1/20 0.42
HPGD P15428 1/20 0.42
RAB9A P51151 1/20 0.42
CHRM3 P20309 1/20 0.42

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
SCHEMBL4107917 0.93 LMNA (0.64) LMNAPOLBTMPRSS4KCNMA1NTRK1
SCHEMBL302846 0.91 LMNA (0.61) LMNAPOLBTMPRSS4NTRK1GRM5
SCHEMBL4455673 0.90 LMNA (0.60) LMNAPOLBKCNMA1NTRK1GRM5
SCHEMBL675130 0.90 LMNA (0.51) LMNAPOLBNTRK1BACE1BACE2
SCHEMBL302426 0.89 LMNA (0.64) LMNAPOLBTMPRSS4NTRK1GRM5
SCHEMBL303186 0.88 LMNA (0.56) LMNAPOLBNTRK1BACE1BACE2
SCHEMBL1085546 0.88 LMNA (0.53) LMNAPOLBNTRK1BACE1BACE2
SCHEMBL29390999 0.88 LMNA (0.53) LMNAPOLBNTRK1BACE1BACE2
SCHEMBL1085759 0.87 LMNA (0.55) LMNAPOLBNTRK1BACE1BACE2
SCHEMBL4450127 0.87 ATM (0.57) KCNMA1JAK2JAK1MEN1KMT2A

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-20090042724-A1 Fungicidal mixtures based on 2,4-disubstituted n-biphenylpyrazolecarboxamides BASF AKTIENGESELLSCHAFT (DE) 2009-02-12 US claimed
US-20190191707-A1 COMPOSITIONS COMPRISING BACILLUS LICHENIFORMIS AND BACILLUS SUBTILIS AND METHODS OF USE FOR CONTROLLING FUNGAL PATHOGENS FMC CORP (US) 2019-06-27 US disclosed
US-20090042724-A1 Fungicidal mixtures based on 2,4-disubstituted n-biphenylpyrazolecarboxamides BASF AKTIENGESELLSCHAFT (DE) 2009-02-12 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-20090042724-A1 Fungicidal mixtures based on 2,4-disubstituted n-biphenylpyrazolecarboxamides CBR3, CBR1, SNU13 LMNA 3266/4885POLB 3502/4885TMPRSS4 3462/4885

“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.