SCHEMBL17482149

SCHEMBL17482149

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

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 1/20 0.39
GPBAR1 Q8TDU6 16/20 0.38
RXFP1 Q9HBX9 1/20 0.37
KDM4E B2RXH2 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL1766850 0.94 GPBAR1 (0.38) MLYCDGPBAR1RXFP1
SCHEMBL17482147 0.94 GPBAR1 (0.40) MLYCDGPBAR1RXFP1
SCHEMBL1766977 0.92 NR1H3 (0.38) RXFP1KMT2ASMN1; SMN2
SCHEMBL1767229 0.91 KDM4E (0.36) GPBAR1RXFP1KDM4EKMT2ASMN1; SMN2
SCHEMBL17482100 0.90 MLYCD (0.43) MLYCDGPBAR1RXFP1KMT2A
SCHEMBL17482153 0.89 GPBAR1 (0.43) MLYCDGPBAR1RXFP1
SCHEMBL14844306 0.88 GPBAR1 (0.40) MLYCDGPBAR1RXFP1SMN1; SMN2
SCHEMBL17482148 0.88 MLYCD (0.42) MLYCDRXFP1KMT2ASMN1; SMN2
SCHEMBL1766774 0.88 KCNJ11 (0.36) KDM4EKMT2ASMN1; SMN2
SCHEMBL17482150 0.87 SMN1; SMN2 (0.31) GPBAR1RXFP1KMT2ASMN1; SMN2

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 1777/4885GPBAR1 2100/4885RXFP1 3170/4885
US-20160029624-A1 INSECTICIDAL COMPOUNDS ACHE, HDAC6, TUBA3C MLYCD 1777/4885GPBAR1 2100/4885RXFP1 3170/4885

“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.