SCHEMBL12189771

SCHEMBL12189771

O=S(O)c1cc(Nc2nc(F)nc(Nc3ccc(Cl)cc3)n2)c2c(O)c(/N=N/c3ccc4c(S(=O)(=O)O)cccc4c3S(=O)(=O)O)c(S(=O)(=O)O)cc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 1/20 0.52
▸ ENPP2 Q13822 3/20 0.39
▸ CYP1A2 P05177 4/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ DNASE1L3 Q13609 1/20 0.35
▸ MEN1 O00255 3/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ THRB P10828 2/20 0.34
▸ P2RX7 Q99572 1/20 0.33
▸ P2RX2 Q9UBL9 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ PHLPP2 Q6ZVD8 1/20 0.32
▸ PRMT1 Q99873 2/20 0.32
▸ CD40 P25942 1/20 0.32
▸ CD40LG P29965 1/20 0.32
▸ HTT P42858 1/20 0.30
▸ CARM1 Q86X55 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ HIF1A Q16665 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
SCHEMBL12974350 0.90 FUT8 (0.65) FUT8ENPP2CYP1A2CYP2C9MAPK1
SCHEMBL12974423 0.87 ENPP2 (0.48) FUT8ENPP2CYP1A2CYP2C9MAPK1
SCHEMBL12172986 0.84 FUT8 (0.41) FUT8MEN1KMT2ATHRBP2RX7
SCHEMBL13455170 0.82 FUT8 (0.77) FUT8ENPP2CYP1A2CYP2C9MAPK1
SCHEMBL14163968 0.81 FUT8 (0.67) FUT8ENPP2CYP1A2CYP2C9MAPK1
SCHEMBL881768 0.80 FUT8 (0.56) FUT8ENPP2CYP1A2CYP2C9MAPK1
SCHEMBL17484228 0.80 FUT8 (0.70) FUT8ENPP2CYP1A2CYP2C9MAPK1
SCHEMBL45618 0.78 FUT8 (0.56) FUT8ENPP2CYP1A2CYP2C9MAPK1
SCHEMBL18801615 0.78 FUT8 (0.54) FUT8ENPP2CYP1A2CYP2C9MAPK1
SCHEMBL14163926 0.78 FUT8 (0.62) FUT8ENPP2CYP1A2CYP2C9MAPK1

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-9403987-B2 Charged particles BASF SE (DE) 2016-08-02 — — US disclosed
US-20120229884-A1 CHARGED PARTICLES BASF SE (DE) 2012-09-13 — — 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-20120229884-A1 CHARGED PARTICLES POLE3, POLD3, IPO4 FUT8 769/4885ENPP2 1649/4885CYP1A2 4304/4885

“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.

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