SCHEMBL3223567

SCHEMBL3223567

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

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LSS P48449 1/20 0.41
ENPP1 P22413 5/20 0.41
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
EGLN2 Q96KS0 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
CXCR1 P25024 1/20 0.37
DRD2 P14416 1/20 0.37
DRD3 P35462 1/20 0.37
UBE2M P61081 1/20 0.36
DCUN1D1 Q96GG9 1/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
TSHR P16473 1/20 0.36
KMT2A Q03164 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
SCHEMBL4494003 0.90 LSS (0.40) LSSKDM4EMAPTMAPK1EGLN2
SCHEMBL976567 0.81 KDM4E (0.48) ENPP1KDM4EMAPTMAPK1ALDH1A1
SCHEMBL3217162 0.81 KDM4E (0.42) ENPP1KDM4EMAPTMAPK1ALDH1A1
SCHEMBL3227902 0.79 KDM4E (0.46) ENPP1KDM4EMAPTMAPK1ALDH1A1
SCHEMBL3223559 0.77 PDE2A (0.38) EGLN2
SCHEMBL4815261 0.77 KDM4E (0.40) KDM4EMAPTMAPK1UBE2MDCUN1D1
SCHEMBL4820837 0.77 KDM4E (0.41) KDM4EMAPTMAPK1ALDH1A1POLB
SCHEMBL4492293 0.77 ALDH1A1 (0.37) KDM4EMAPTMAPK1ALDH1A1POLB
SCHEMBL4475964 0.76 ALDH1A1 (0.42) KDM4EMAPTMAPK1HRH3ALDH1A1
SCHEMBL7000548 0.74 KDM4E (0.42) ENPP1KDM4EMAPTMAPK1UBE2M

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 LSS 469/4885ENPP1 184/4885KDM4E 2348/4885

“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.