SCHEMBL7545625

SCHEMBL7545625

O=C1NN=CC1=CNc1ccc(F)cc1F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.39
MEN1 O00255 3/20 0.39
HTT P42858 3/20 0.37
ALDH1A1 P00352 6/20 0.35
CYP2C19 P33261 1/20 0.35
MAPT P10636 6/20 0.35
NPC1 O15118 4/20 0.35
RAB9A P51151 4/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
PKM P14618 2/20 0.35
TP53 P04637 1/20 0.35
HPGD P15428 1/20 0.35
POLB P06746 3/20 0.34
GAA P10253 2/20 0.34
LMNA P02545 3/20 0.34
PABPC1 P11940 1/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
CTDSP1 Q9GZU7 1/20 0.33

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
SCHEMBL7545623 1.00 KMT2A (0.39) KMT2AMEN1HTTALDH1A1CYP2C19
SCHEMBL7549492 0.77 P2RX7 (0.36) SMN1; SMN2GAAKDM4E
SCHEMBL7549483 0.77 P2RX7 (0.36) SMN1; SMN2GAAKDM4E
SCHEMBL7552973 0.74 KMT2A (0.45) KMT2AMEN1HTTALDH1A1CYP2C19
SCHEMBL7554267 0.72 KMT2A (0.45) KMT2AMEN1HTTALDH1A1CYP2C19
SCHEMBL7554269 0.72 KMT2A (0.45) KMT2AMEN1HTTALDH1A1CYP2C19
SCHEMBL988638 0.67 ALDH1A1 (0.47) KMT2AMEN1HTTALDH1A1CYP2C19
SCHEMBL11887923 0.66 KDR (0.53) KMT2AMEN1HTTALDH1A1MAPT
SCHEMBL10466153 0.63 LMNA (0.44) KMT2AMEN1HTTALDH1A1CYP2C19
SCHEMBL10703851 0.60 ALDH1A1 (0.64) KMT2AMEN1HTTALDH1A1CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020058244-A1 Method for detecting uracil biosynthesis inhibitors and their use as herbicides BASF AKTIENGESELLSCHAFT (DE) 2002-05-16 US claimed
US-20020058244-A1 Method for detecting uracil biosynthesis inhibitors and their use as herbicides BASF AKTIENGESELLSCHAFT (DE) 2002-05-16 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-20020058244-A1 Method for detecting uracil biosynthesis inhibitors and their use as herbicides UMPS, UGP2, UNG KMT2A 2193/4885MEN1 4364/4885HTT 3118/4885

“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.