SCHEMBL17437529

SCHEMBL17437529

Nc1ncnn1-c1nc2cncc(-c3ccccc3F)c2n1C1CC1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 13/20 0.37
▸ CYP11B1 P15538 12/20 0.37
▸ RXFP1 Q9HBX9 1/20 0.34
▸ PDE10A Q9Y233 1/20 0.33
▸ CYP3A4 P08684 3/20 0.32
▸ CYP19A1 P11511 1/20 0.32
▸ CYP1A2 P05177 3/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32

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
SCHEMBL17437312 0.95 KDM4E (0.34) CYP11B2CYP11B1RXFP1ALDH1A1ALOX15
SCHEMBL17437486 0.89 SLC9A1 (0.33) CYP11B2CYP11B1CYP3A4CYP1A2ALDH1A1
SCHEMBL17437480 0.84 KDM4E (0.34) CYP3A4CYP1A2ALDH1A1ALOX15
SCHEMBL17437512 0.83 CYP11B2 (0.34) CYP11B2PDE10A
SCHEMBL17437313 0.81 MAPT (0.34) CYP3A4CYP1A2ALDH1A1TSHRCYP2C19
SCHEMBL17437394 0.81 CYP1A2 (0.33) CYP11B2CYP11B1CYP3A4CYP1A2ALOX15
SCHEMBL17437460 0.80 RPS6KA5 (0.34) PDE10ACYP1A2
SCHEMBL17437330 0.79 ADORA3 (0.32) CYP3A4CYP1A2ALDH1A1CYP2C19
SCHEMBL17437537 0.79 CYP3A4 (0.36) CYP11B2CYP11B1CYP3A4CYP19A1CYP1A2
SCHEMBL17437573 0.78 TLR8 (0.36) ALDH1A1

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 CYP11B2 1464/4885CYP11B1 1360/4885RXFP1 3140/4885
US-20160016949-A1 MICROBICIDALLY ACTIVE IMIDAZOPYRIDINE DERIVATIVES IDO1, IDO2, FOXM1 CYP11B2 1464/4885CYP11B1 1360/4885RXFP1 3140/4885

“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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