SCHEMBL3217162

SCHEMBL3217162

Cc1nc2ncnn2c(-c2ccccc2)c1-c1c(F)cc(OC(C)(C)C)cc1F

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.42
MAPK1 P28482 3/20 0.42
MAPT P10636 2/20 0.42
ALDH1A1 P00352 9/20 0.40
HPGD P15428 2/20 0.40
POLB P06746 2/20 0.40
GAA P10253 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 2/20 0.39
GLA P06280 1/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
GFER P55789 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ENPP1 P22413 1/20 0.37
TSHR P16473 3/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALOX15 P16050 1/20 0.36
AURKA O14965 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
SCHEMBL976567 0.85 KDM4E (0.48) KDM4EMAPK1MAPTALDH1A1HPGD
SCHEMBL3227902 0.83 KDM4E (0.46) KDM4EMAPK1MAPTALDH1A1HPGD
SCHEMBL3223567 0.81 LSS (0.41) KDM4EMAPK1MAPTALDH1A1POLB
SCHEMBL4813019 0.77 KDM4E (0.48) KDM4EMAPK1MAPTALDH1A1HPGD
SCHEMBL5731717 0.77 ALDH1A1 (0.46) KDM4EMAPK1MAPTALDH1A1POLB
SCHEMBL4811916 0.76 ALDH1A1 (0.47) KDM4EMAPK1MAPTALDH1A1HPGD
SCHEMBL3217156 0.75 PDE2A (0.38)
SCHEMBL7000368 0.74 KDM4E (0.46) KDM4EMAPK1MAPTALDH1A1HPGD
SCHEMBL6990136 0.74 KDM4E (0.45) KDM4EMAPK1MAPTALDH1A1HPGD
SCHEMBL6995162 0.73 KDM4E (0.43) KDM4EMAPK1MAPTALDH1A1HPGD

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-20100056371-A1 Use of Azolopyrimidines for Controlling Phytopathogenic Harmful Fungi BASF SE (DE) 2010-03-04 US disclosed
EP-2117312-A1 USE OF AZOLOPYRIMIDINES FOR FIGHTING PLANT PATHOGENIC FUNGI BASF SE (DE) 2009-11-18 EP disclosed
WO-2008084027-A1 USE OF AZOLOPYRIMIDINES FOR FIGHTING PLANT PATHOGENIC FUNGI BASF SE (DE) 2008-07-17 WO 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-20100056371-A1 Use of Azolopyrimidines for Controlling Phytopathogenic Harmful Fungi DPM1, TYMP, G6PD KDM4E 2348/4885MAPK1 998/4885MAPT 1488/4885

“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.