SCHEMBL3063181

SCHEMBL3063181

Cc1nnc(Cl)c(-c2ncc(Cl)cc2Cl)c1Cc1ccc(Cl)cc1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.38
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
KMT2A Q03164 3/20 0.36
CRHR1 P34998 5/20 0.35
ENPP1 P22413 1/20 0.34
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
ENPP2 Q13822 1/20 0.33
MEN1 O00255 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ALOX12 P18054 1/20 0.31
TP53 P04637 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
ALKBH3 Q96Q83 1/20 0.30

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
SCHEMBL3070637 0.94 CRHR1 (0.34) POLBMAPTKDM4EKMT2ACRHR1
SCHEMBL896318 0.79 CNR2 (0.37) POLBMAPTKDM4EKMT2ACRHR1
SCHEMBL3569381 0.74 CNR2 (0.42) MAPTKDM4EPTGS1PTGS2L3MBTL1
SCHEMBL3063211 0.74 KMT2A (0.38) POLBMAPTKDM4EKMT2AENPP1
SCHEMBL10000761 0.72 MAOB (0.40) MAPTKDM4EKMT2ACRHR1PTGS1
SCHEMBL3063953 0.72 KMT2A (0.36) POLBMAPTKDM4EKMT2AENPP1
SCHEMBL10000738 0.70 CNR2 (0.35) KDM4EKMT2ACRHR1PTGS1PTGS2
SCHEMBL3609800 0.70 PTGS2 (0.43) CRHR1PTGS1PTGS2
SCHEMBL3604528 0.70 CNR2 (0.38) KDM4EKMT2ACRHR1PTGS1PTGS2
SCHEMBL14114403 0.70 HEXA (0.39) KMT2ACRHR1PTGS1PTGS2MEN1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100273804-A1 PYRIDAZINE DERIVATIVES USEFUL AS FUNGICIDES AND FOR THE TREATMENT OF CANCER SYNGENTA CROP PROTECTION, INC. (US) 2010-10-28 US claimed
EP-2220051-A1 PYRIDAZINE DERIVATIVES USEFUL AS FUNGICIDES AND FOR THE TREATMENT OF CANCER Syngenta Participations AG (CH) 2010-08-25 EP claimed
WO-2009080314-A1 PYRIDAZINE DERIVATIVES USEFUL AS FUNGICIDES AND FOR THE TREATMENT OF CANCER SYNGENTA PARTICIPATIONS AG (CH) 2009-07-02 WO claimed
US-20100273804-A1 PYRIDAZINE DERIVATIVES USEFUL AS FUNGICIDES AND FOR THE TREATMENT OF CANCER SYNGENTA CROP PROTECTION, INC. (US) 2010-10-28 US disclosed
EP-2220051-A1 PYRIDAZINE DERIVATIVES USEFUL AS FUNGICIDES AND FOR THE TREATMENT OF CANCER Syngenta Participations AG (CH) 2010-08-25 EP disclosed
WO-2009080314-A1 PYRIDAZINE DERIVATIVES USEFUL AS FUNGICIDES AND FOR THE TREATMENT OF CANCER SYNGENTA PARTICIPATIONS AG (CH) 2009-07-02 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-20100273804-A1 PYRIDAZINE DERIVATIVES USEFUL AS FUNGICIDES AND FOR THE TREATMENT OF CANCER C3AR1, CBR3, C1S POLB 4472/4885MAPT 4845/4885KDM4E 3892/4885

“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.