SCHEMBL17437422

SCHEMBL17437422

CCn1c(-n2ncnc2N)nc2cncc(-c3cccnc3Cl)c21

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.42
RPS6KA5 O75582 2/20 0.39
LMNA P02545 2/20 0.36
MAPT P10636 1/20 0.33
CDC7 O00311 2/20 0.32
CDK2 P24941 1/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
DHODH Q02127 1/20 0.31
NPSR1 Q6W5P4 2/20 0.31
ADORA1 P30542 1/20 0.31
GAA P10253 1/20 0.30
RECQL P46063 1/20 0.30

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
SCHEMBL17437368 0.88 RPS6KA5 (0.39) KDM4ERPS6KA5
SCHEMBL17437506 0.88 RPS6KA5 (0.34) KDM4ERPS6KA5CYP1A2CYP2C19
SCHEMBL17437554 0.86 RPS6KA5 (0.38) RPS6KA5
SCHEMBL17437443 0.86 PTPN11 (0.34) RPS6KA5
SCHEMBL17437323 0.85 RPS6KA5 (0.34) KDM4ERPS6KA5
SCHEMBL17437337 0.85 GRIN2B (0.33) KDM4ERPS6KA5
SCHEMBL17437460 0.85 RPS6KA5 (0.34) RPS6KA5CYP1A2
SCHEMBL16053847 0.85 RPS6KA5 (0.36) RPS6KA5ALDH1A1CYP1A2CYP2C19RECQL
SCHEMBL17437352 0.84 DYRK1A (0.36) RPS6KA5
SCHEMBL17437576 0.83 HTR2C (0.35) KDM4ERPS6KA5MAPTCDK2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170050963-A1 MICROBICIDALLY ACTIVE IMIDAZOPYRIDINE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2017-02-23 US disclosed
US-9512120-B2 Microbicidally active imidazopyridine derivatives SYNGENTA PARTICIPATIONS AG (CH) 2016-12-06 US disclosed
US-20160016949-A1 MICROBICIDALLY ACTIVE IMIDAZOPYRIDINE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2016-01-21 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-20170050963-A1 MICROBICIDALLY ACTIVE IMIDAZOPYRIDINE DERIVATIVES IDO1, IDO2, FOXM1 KDM4E 1452/4885RPS6KA5 2731/4885LMNA 3896/4885
US-20160016949-A1 MICROBICIDALLY ACTIVE IMIDAZOPYRIDINE DERIVATIVES IDO1, IDO2, FOXM1 KDM4E 1452/4885RPS6KA5 2731/4885LMNA 3896/4885

“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.