SCHEMBL4451146

SCHEMBL4451146

Cn1cc(C(=O)Nc2ccccc2-c2cc(F)cc(Cl)c2)c(CF)n1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 15/20 0.51
ATM Q13315 1/20 0.43
SSTR2 P30874 1/20 0.43
NTRK1 P04629 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 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
SCHEMBL4913313 0.94 SSTR2 (0.48) CHRM3ATMSSTR2NTRK1TDP1
SCHEMBL4451470 0.93 ATM (0.47) CHRM3ATMNTRK1
SCHEMBL4171956 0.88 JAK2 (0.48) CHRM3ATMTDP1JAK2JAK1
SCHEMBL4159066 0.87 CHRM3 (0.48) CHRM3ATMNTRK1JAK2JAK1
SCHEMBL4456706 0.86 CHRM3 (0.51) CHRM3ATMSSTR2NTRK1TDP1
SCHEMBL2346206 0.86 CHRM3 (0.51) CHRM3ATMNTRK1TDP1
SCHEMBL1085544 0.85 CHRM3 (0.47) CHRM3ATMNTRK1
SCHEMBL29445377 0.85 CHRM3 (0.47) CHRM3ATMNTRK1
SCHEMBL4450835 0.85 LMNA (0.56) CHRM3ATMSSTR2NTRK1
SCHEMBL4920171 0.85 CHRM3 (0.48) CHRM3ATMNTRK1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090042725-A1 Fungicidal Mixtures Based on 3,5-Disubstituted N-Biphenyl-Pyrazolcarboxamides BASF AKTIENGESELLSCHAFT (DE) 2009-02-12 US claimed
US-20090042725-A1 Fungicidal Mixtures Based on 3,5-Disubstituted N-Biphenyl-Pyrazolcarboxamides 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-20090042725-A1 Fungicidal Mixtures Based on 3,5-Disubstituted N-Biphenyl-Pyrazolcarboxamides CBR3, CBR1, STS CHRM3 328/4885ATM 4479/4885SSTR2 313/4885

“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.