SCHEMBL17437486

SCHEMBL17437486

Nc1ncnn1-c1nc2cncc(-c3ccccc3Cl)c2n1C1CC1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SLC9A1 P19634 1/20 0.33
▸ CYP11B1 P15538 1/20 0.33
▸ CYP11B2 P19099 1/20 0.33
▸ CYP1A2 P05177 3/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ ALOX15 P16050 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ LIMK1 P53667 1/20 0.31
▸ PTPN11 Q06124 2/20 0.31
▸ CNR2 P34972 2/20 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
SCHEMBL17437480 0.95 KDM4E (0.34) SLC9A1CYP1A2CYP3A4CYP2D6HSD17B10
SCHEMBL17437312 0.84 KDM4E (0.34) CYP11B1CYP11B2ALOX15ALDH1A1
SCHEMBL17437381 0.84 CRHR1 (0.35) ALDH1A1CNR2
SCHEMBL17437310 0.83 CYP1A2 (0.40) CYP1A2CYP3A4CYP2D6HSD17B10ALOX15
SCHEMBL17437482 0.81 MEN1 (0.33) CYP1A2CYP3A4CYP2D6HSD17B10ALDH1A1
SCHEMBL17437506 0.80 RPS6KA5 (0.34) SLC9A1CYP1A2CYP3A4CYP2D6HSD17B10
SCHEMBL17437378 0.79 TLR8 (0.35) CYP1A2CYP3A4CYP2D6HSD17B10LIMK1
SCHEMBL17437537 0.78 CYP3A4 (0.36) CYP11B1CYP11B2CYP1A2CYP3A4ALDH1A1
SCHEMBL17437345 0.75 CYP11B1 (0.35) CYP11B1CYP11B2CYP1A2CYP3A4ALDH1A1
SCHEMBL17437327 0.73 ADORA3 (0.39) —

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 SLC9A1 3847/4885CYP11B1 1360/4885CYP11B2 1464/4885
US-20160016949-A1 MICROBICIDALLY ACTIVE IMIDAZOPYRIDINE DERIVATIVES IDO1, IDO2, FOXM1 SLC9A1 3847/4885CYP11B1 1360/4885CYP11B2 1464/4885

“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.

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