SCHEMBL3021786

SCHEMBL3021786

CCOC(=O)C(C)=NN(C)C(=O)Cc1c(F)cccc1Cl

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
MEN1 O00255 3/20 0.47
ALDH1A1 P00352 4/20 0.46
TDP1 Q9NUW8 2/20 0.46
ALOX15 P16050 1/20 0.46
MAPT P10636 2/20 0.44
HTT P42858 1/20 0.44
GAA P10253 1/20 0.44
POLB P06746 2/20 0.44
KDM4E B2RXH2 2/20 0.44
TSHR P16473 2/20 0.44
RXFP1 Q9HBX9 1/20 0.44
ATM Q13315 1/20 0.43
SCN9A Q15858 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL26076423 0.85 MAPT (0.34) KMT2ASMN1; SMN2MEN1ALDH1A1TDP1
SCHEMBL22031805 0.85 MAPT (0.34) KMT2ASMN1; SMN2MEN1ALDH1A1TDP1
SCHEMBL13873152 0.84 KMT2A (0.44) KMT2ASMN1; SMN2MEN1ALDH1A1TDP1
SCHEMBL3014458 0.80 AKR1B1 (0.41) KMT2ASMN1; SMN2MEN1ALDH1A1MAPT
SCHEMBL18191124 0.80 ALDH1A1 (0.35) KMT2ASMN1; SMN2MEN1ALDH1A1TDP1
SCHEMBL7638197 0.79 KMT2A (0.56) KMT2ASMN1; SMN2MEN1ALDH1A1TDP1
SCHEMBL3021784 0.78 SMN1; SMN2 (0.48) KMT2ASMN1; SMN2MEN1ALDH1A1TDP1
SCHEMBL3021788 0.78 SMN1; SMN2 (0.48) KMT2ASMN1; SMN2MEN1ALDH1A1TDP1
SCHEMBL3785204 0.78 ABCB1 (0.43) KMT2ASMN1; SMN2MEN1ALDH1A1TDP1
SCHEMBL509000 0.77 ABCB1 (0.39) KMT2ASMN1; SMN2MEN1ALDH1A1TDP1

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
EP-2379509-B1 HERBICIDAL AND INSECTICIDAL PHENYL-SUBSTITUTED PYRIDAZINONES BAYER IP GMBH (DE) 2016-02-17 EP disclosed
US-8242055-B2 Herbicidally and insecticidally active phenyl-substituted pyridazinones BAYER CROPSCIENCE AG (DE) 2012-08-14 US disclosed
US-20100184602-A1 HERBICIDALLY AND INSECTICIDALLY ACTIVE PHENYL-SUBSTITUTED PYRIDAZINONES BAYER CROPSCIENCE AG (DE) 2010-07-22 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-20100184602-A1 HERBICIDALLY AND INSECTICIDALLY ACTIVE PHENYL-SUBSTITUTED PYRIDAZINONES CYP4X1, PRDX1, PNPO KMT2A 1579/4885SMN1; SMN2 3492/4885MEN1 4643/4885

“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.