SCHEMBL17482158

SCHEMBL17482158

CCN(C(=O)c1ccncc1)c1cccc(C(=O)Nc2c(Cl)cc(C(F)(C(F)(F)F)C(F)(F)F)cc2Cl)c1F

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 1/20 0.42
TYK2 P29597 2/20 0.39
RXFP1 Q9HBX9 1/20 0.35
DHODH Q02127 5/20 0.35
JAK2 O60674 2/20 0.35
JAK1 P23458 1/20 0.35
TSHR P16473 1/20 0.35
GPBAR1 Q8TDU6 4/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TRPV4 Q9HBA0 1/20 0.33
HDAC8 Q9BY41 1/20 0.33

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
SCHEMBL17482159 0.96 MLYCD (0.40) MLYCDTYK2RXFP1DHODHJAK2
SCHEMBL17482152 0.95 MLYCD (0.39) MLYCDTYK2RXFP1DHODHJAK2
SCHEMBL16156489 0.94 MLYCD (0.39) MLYCDTYK2RXFP1DHODHJAK2
SCHEMBL17482112 0.91 HTT (0.41) MLYCDRXFP1TSHR
SCHEMBL17482156 0.91 DHODH (0.37) MLYCDDHODH
SCHEMBL17484781 0.90 MLYCD (0.42) MLYCDTYK2RXFP1TSHRGPBAR1
SCHEMBL17482148 0.90 MLYCD (0.42) MLYCDTYK2RXFP1TSHRTRPV4
SCHEMBL17482153 0.88 GPBAR1 (0.43) MLYCDTYK2RXFP1JAK2JAK1
SCHEMBL17482107 0.87 HTT (0.39) RXFP1TSHRKDM4EALDH1A1TRPV4
SCHEMBL17484742 0.86 MLYCD (0.38) MLYCDTYK2RXFP1DHODHJAK2

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 1777/4885TYK2 4800/4885RXFP1 3170/4885
US-20160029624-A1 INSECTICIDAL COMPOUNDS ACHE, HDAC6, TUBA3C MLYCD 1777/4885TYK2 4800/4885RXFP1 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.