SCHEMBL17482148

SCHEMBL17482148

CCN(C(=O)c1ccncc1)c1cccc(C(=O)Nc2c(Br)cc(C(F)(C(F)(F)F)C(F)(F)F)cc2Br)c1F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 3/20 0.42
RXFP1 Q9HBX9 1/20 0.35
TSHR P16473 1/20 0.35
HDAC8 Q9BY41 2/20 0.35
TRPV4 Q9HBA0 1/20 0.33
TRPA1 O75762 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
ABL1 P00519 1/20 0.32
EGFR P00533 1/20 0.32
CSF1R P07333 1/20 0.32
PDGFRB P09619 1/20 0.32
KIT P10721 1/20 0.32
FLT1 P17948 1/20 0.32
FLT4 P35916 1/20 0.32
KDR P35968 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
LMNA P02545 1/20 0.31
GFER P55789 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL16156489 0.94 MLYCD (0.39) MLYCDRXFP1TSHRHDAC8TRPV4
SCHEMBL17482154 0.91 MLYCD (0.37) MLYCDRXFP1TSHRHDAC8TRPV4
SCHEMBL17482099 0.91 HTT (0.41) MLYCDRXFP1TSHRTRPV4TRPA1
SCHEMBL16863522 0.91 MLYCD (0.36) MLYCDRXFP1TSHRHDAC8
SCHEMBL18355978 0.90 MLYCD (0.37) MLYCDRXFP1TSHRHDAC8TRPV4
SCHEMBL17484781 0.90 MLYCD (0.42) MLYCDRXFP1TSHRHDAC8TRPV4
SCHEMBL17482158 0.90 MLYCD (0.42) MLYCDRXFP1TSHRHDAC8TRPV4
SCHEMBL17482149 0.88 MLYCD (0.39) MLYCDRXFP1KMT2ASMN1; SMN2
SCHEMBL18355928 0.88 MLYCD (0.35) MLYCDRXFP1
SCHEMBL23059611 0.88 GPBAR1 (0.40) MLYCDRXFP1TRPV4ABL1EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9975845-B2 Insecticidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2018-05-22 US disclosed
US-9975845-B2 Insecticidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2018-05-22 US disclosed
US-20170152214-A1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2017-06-01 US disclosed
US-20170152214-A1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2017-06-01 US disclosed
US-9635853-B2 Insecticidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2017-05-02 US disclosed
US-9635853-B2 Insecticidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2017-05-02 US disclosed
US-20160029624-A1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-02-04 US disclosed
US-20160029624-A1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-02-04 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-20170152214-A1 INSECTICIDAL COMPOUNDS ACHE, HDAC6, TUBA3C MLYCD 1777/4885RXFP1 3170/4885TSHR 3230/4885
US-20160029624-A1 INSECTICIDAL COMPOUNDS ACHE, HDAC6, TUBA3C MLYCD 1777/4885RXFP1 3170/4885TSHR 3230/4885

“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.