SCHEMBL17482105

SCHEMBL17482105

CN(C(=O)c1cccnc1)c1cccc(C(=O)N(C)c2c(Br)cc(C(F)(C(F)(F)F)C(F)(F)F)cc2Br)c1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 2/20 0.54
HSD17B10 Q99714 3/20 0.40
KDM4E B2RXH2 1/20 0.40
GPBAR1 Q8TDU6 5/20 0.39
HTT P42858 1/20 0.39
RORC P51449 1/20 0.38
PRMT5 O14744 1/20 0.38
WDR77 Q9BQA1 1/20 0.38
TRPV1 Q8NER1 1/20 0.37
POLQ O75417 1/20 0.37
NR1H3 Q13133 2/20 0.37
NR1H2 P55055 1/20 0.37
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
MEN1 O00255 1/20 0.36
TSHR P16473 1/20 0.36
KMT2A Q03164 1/20 0.36
ALOX15 P16050 1/20 0.36

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
SCHEMBL1767213 0.80 NR1H3 (0.45) KDM4EGPBAR1POLQNR1H3NR1H2
SCHEMBL17482095 0.80 MLYCD (0.44) MLYCDGPBAR1
SCHEMBL1766297 0.78 GPBAR1 (0.36) MLYCDGPBAR1HTTPOLQNPC1
SCHEMBL17482094 0.78 MLYCD (0.41) MLYCDGPBAR1RORC
SCHEMBL1766434 0.76 HSD17B10 (0.37) HSD17B10KDM4EGPBAR1HTTNR1H3
SCHEMBL1766739 0.75 NR1H3 (0.38) MLYCDHSD17B10KDM4EGPBAR1HTT
SCHEMBL17482100 0.74 MLYCD (0.43) MLYCDGPBAR1RORCNPC1RAB9A
SCHEMBL12978268 0.73 GPBAR1 (0.59) MLYCDHSD17B10GPBAR1TRPV1POLQ
SCHEMBL16155782 0.72 MLYCD (0.36) MLYCDKDM4EGPBAR1HTTRORC
SCHEMBL1766674 0.72 PTGS1 (0.40) GPBAR1NR1H3NR1H2MEN1KMT2A

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-9402395-B2 Insecticidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2016-08-02 US disclosed
US-9402395-B2 Insecticidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2016-08-02 US disclosed
US-20160029623-A1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-02-04 US disclosed
US-20160029623-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 (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-20160029623-A1 INSECTICIDAL COMPOUNDS ACHE, HDAC6, TUBA3C MLYCD 1777/4885HSD17B10 2130/4885KDM4E 2440/4885

“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.