SCHEMBL3107978

SCHEMBL3107978

Fc1ccc(-c2nn3c(c2-c2ccnc(Cl)n2)CCNC3)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 2/20 0.42
THRB P10828 2/20 0.40
TGFBR1 P36897 1/20 0.36
MAPK14 Q16539 3/20 0.36
MAPK13 O15264 1/20 0.36
RIPK2 O43353 1/20 0.36
DYRK3 O43781 1/20 0.36
PRKD3 O94806 1/20 0.36
MAP4K4 O95819 1/20 0.36
PRKCG P05129 1/20 0.36
LCK P06239 1/20 0.36
LYN P07948 1/20 0.36
RET P07949 1/20 0.36
PIM1 P11309 1/20 0.36
PRKACA P17612 1/20 0.36
MAPK1 P28482 1/20 0.36
FLT4 P35916 1/20 0.36
KDR P35968 1/20 0.36
MAPK9 P45984 1/20 0.36
CSNK1A1 P48729 1/20 0.36

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
SCHEMBL3109621 0.85 MAPK14 (0.46) CSNK1DTHRBTGFBR1MAPK14MAPK13
SCHEMBL3100630 0.83 PTGS2 (0.39) CSNK1DTHRBMAPK14
SCHEMBL3110918 0.83 THRB (0.54) CSNK1DTHRBTGFBR1MAPK14
SCHEMBL3105147 0.81 CSNK1D (0.60) CSNK1DMAPK14MAPK13PRKD3MAP4K4
SCHEMBL3107780 0.81 KCNH2 (0.46) CSNK1DMAPK14MAPK13PRKD3MAP4K4
SCHEMBL3113155 0.80 CSNK1D (0.51) CSNK1DMAPK14MAPK13PRKD3MAP4K4
SCHEMBL3099814 0.79 CSNK1D (0.38) CSNK1DTHRBTGFBR1MAPK14MAPK13
SCHEMBL3090683 0.73 THRB (0.41) CSNK1DTHRBTGFBR1MAPK14MAP4K4
SCHEMBL25219496 0.71 MAPK14 (0.48) CSNK1DMAPK14MAPK13RIPK2DYRK3
SCHEMBL29994100 0.71 MAPK14 (0.48) CSNK1DMAPK14MAPK13RIPK2DYRK3

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-20100273775-A1 FUNGICIDAL BICYCLIC PYRAZOLES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2010-10-28 US claimed
US-8288375-B2 Fungicidal bicyclic pyrazoles E.I. DU PONT DE NEMOURS AND COMPANY (US) 2012-10-16 US disclosed
US-20100273775-A1 FUNGICIDAL BICYCLIC PYRAZOLES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2010-10-28 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 (1 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-20100273775-A1 FUNGICIDAL BICYCLIC PYRAZOLES CYP1B1, CBR1, CYP1A1 CSNK1D 1670/4885THRB 4120/4885TGFBR1 1459/4885

“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.