SCHEMBL20474237

SCHEMBL20474237

CC1(C)N=C(c2cnc3cc(I)ccn23)c2cccc(F)c2C1(C)C

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 4/20 0.36
GABRB3 P28472 4/20 0.36
GABRA3 P34903 4/20 0.36
GABRA1 P14867 3/20 0.36
FLT3 P36888 9/20 0.36
GABRA5 P31644 1/20 0.35
GABRA2 P47869 1/20 0.35
KDR P35968 6/20 0.34
PIK3CA P42336 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
SCHEMBL20474150 0.89 GABRG2 (0.38) GABRG2GABRB3GABRA3GABRA1FLT3
SCHEMBL20474157 0.88 GABRG2 (0.47) GABRG2GABRB3GABRA3GABRA1FLT3
SCHEMBL30829063 0.88 GABRG2 (0.47) GABRG2GABRB3GABRA3GABRA1FLT3
SCHEMBL20474191 0.85 FLT3 (0.46) FLT3PIK3CA
SCHEMBL20474169 0.85 FLT3 (0.43) GABRG2GABRB3GABRA3GABRA1FLT3
SCHEMBL20474188 0.84 GABRG2 (0.44) GABRG2GABRB3GABRA3GABRA1FLT3
SCHEMBL20474238 0.80 FLT3 (0.36) FLT3
SCHEMBL20474167 0.79 MKNK1 (0.36)
SCHEMBL20474212 0.78 IDO1 (0.35) GABRG2GABRB3GABRA3GABRA1GABRA5
SCHEMBL20474243 0.78 LMNA (0.44) GABRG2GABRB3GABRA3GABRA1FLT3

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
EP-3929197-B1 INTERMEDIATES FOR THE SYNTHESIS OF MICROBIOCIDAL HETEROBICYCLIC DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2024-03-06 EP disclosed
EP-3334736-B1 MICROBIOCIDAL HETEROBICYCLIC DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2023-06-28 EP disclosed
EP-3929197-A1 INTERMEDIATES FOR THE SYNTHESIS OF MICROBIOCIDAL HETEROBICYCLIC DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2021-12-29 EP disclosed
US-20210155619-A1 MICROBIOCIDAL HETEROBICYCLIC DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2021-05-27 US disclosed
US-20210155619-A1 MICROBIOCIDAL HETEROBICYCLIC DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2021-05-27 US disclosed
US-10906897-B2 Microbiocidal heterobicyclic derivatives SYNGENTA PARTICIPATIONS AG (CH) 2021-02-02 US disclosed
US-10906897-B2 Microbiocidal heterobicyclic derivatives SYNGENTA PARTICIPATIONS AG (CH) 2021-02-02 US disclosed
US-20180237434-A1 MICROBIOCIDAL HETEROBICYCLIC DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2018-08-23 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 (3 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-10906897-B2 Microbiocidal heterobicyclic derivatives MSR1, C1R, C1S GABRG2 2592/4885GABRB3 3132/4885GABRA3 2934/4885
US-20210155619-A1 MICROBIOCIDAL HETEROBICYCLIC DERIVATIVES CD14, MSR1, MPO GABRG2 1453/4885GABRB3 1367/4885GABRA3 2194/4885
US-20180237434-A1 MICROBIOCIDAL HETEROBICYCLIC DERIVATIVES MSR1, C1R, C1S GABRG2 2592/4885GABRB3 3132/4885GABRA3 2934/4885

“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.