SCHEMBL13420553

SCHEMBL13420553

O=S(=O)(O)c1cc(Nc2nc(Cl)nc(Nc3ccc(Nc4nc(Cl)nc(Nc5cc(SOOO)cc6cc(S(=O)(=O)O)c(N=Nc7ccc8c(S(=O)(=O)O)cccc8c7S(=O)(=O)O)c(O)c56)n4)cc3)n2)c2c(O)c(N=Nc3ccc4c(S(=O)(=O)O)cccc4c3S(=O)(=O)O)c(SOOO)cc2c1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 1/20 0.62
▸ CYP1A2 P05177 3/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ DNASE1L3 Q13609 1/20 0.38
▸ MEN1 O00255 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ THRB P10828 2/20 0.37
▸ ENPP2 Q13822 6/20 0.37
▸ PRMT1 Q99873 2/20 0.35
▸ PHLPP2 Q6ZVD8 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.34
▸ CARM1 Q86X55 1/20 0.34
▸ CD40 P25942 1/20 0.33
▸ CD40LG P29965 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ PTPN11 Q06124 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ HIF1A Q16665 1/20 0.32

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
SCHEMBL14159447 0.95 FUT8 (0.54) FUT8CYP1A2CYP2C9MAPK1DNASE1L3
SCHEMBL14159456 0.92 FUT8 (0.51) FUT8CYP1A2CYP2C9MAPK1DNASE1L3
SCHEMBL14594987 0.89 FUT8 (0.49) FUT8CYP1A2CYP2C9MAPK1DNASE1L3
SCHEMBL13455170 0.89 FUT8 (0.77) FUT8CYP1A2CYP2C9MAPK1DNASE1L3
SCHEMBL13538879 0.89 FUT8 (0.53) FUT8CYP1A2CYP2C9MAPK1DNASE1L3
SCHEMBL14444809 0.89 FUT8 (0.51) FUT8CYP1A2CYP2C9MAPK1DNASE1L3
SCHEMBL13815211 0.88 FUT8 (0.74) FUT8CYP1A2CYP2C9MAPK1DNASE1L3
SCHEMBL14372027 0.86 FUT8 (0.49) FUT8CYP1A2CYP2C9MAPK1DNASE1L3
SCHEMBL8974959 0.85 FUT8 (0.69) FUT8CYP1A2CYP2C9MAPK1DNASE1L3
SCHEMBL17484228 0.85 FUT8 (0.70) FUT8CYP1A2CYP2C9MAPK1DNASE1L3

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-7683208-B2 Bridge compound with N,N-dialkylamino group and application thereof EVERLIGHT USA, INC. (US) 2010-03-23 — — US disclosed
US-20090054645-A1 Bridge compound with N, N-dialkylamino group and application thereof EVERLIGHT USA, INC. (US) 2009-02-26 — — US disclosed
US-7387667-B1 Black dye composition and black ink composition EVERLIGHT USA, INC. (US) 2008-06-17 — — 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-20090054645-A1 Bridge compound with N, N-dialkylamino group and application thereof ALKBH1, ALKBH2, B2M FUT8 886/4885CYP1A2 92/4885CYP2C9 374/4885

“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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