SCHEMBL12189780

SCHEMBL12189780

CCn1c(O)c(/N=N/c2cc(Nc3nc(Cl)nc(Nc4ccc(-c5nc6ccc(C)c(S(=O)(=O)O)c6s5)cc4)n3)ccc2S(=O)(=O)O)c(C)c(C(N)=O)c1=O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ SNCA P37840 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ GLA P06280 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ NT5E P21589 1/20 0.39
▸ CASP1 P29466 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ CASP7 P55210 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ FUT8 Q9BYC5 1/20 0.34
▸ P2RX3 P56373 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
SCHEMBL12173074 0.90 SMN1; SMN2 (0.38) MAPTALDH1A1TP53GAAHPGD
SCHEMBL20390575 0.85 FUT8 (0.40) MAPTALDH1A1FUT8P2RX3
SCHEMBL13764095 0.83 FUT8 (0.38) MAPTALDH1A1FUT8P2RX3
SCHEMBL12053415 0.80 FUT8 (0.38) FUT8P2RX3
SCHEMBL13763511 0.77 CAMK2D (0.31) FUT8
SCHEMBL12646575 0.77 FUT8 (0.38) FUT8
SCHEMBL12173082 0.77 FUT8 (0.38) FUT8
SCHEMBL12189778 0.76 FUT8 (0.39) FUT8P2RX3
SCHEMBL10017408 0.76 FUT8 (0.47) MAPTALDH1A1FUT8
SCHEMBL16626829 0.76 FUT8 (0.40) FUT8

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 4 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
WO-2010149505-A2 CHARGED PARTICLES BASF SE (DE) 2010-12-29 — — WO disclosed
US-20100016519-A1 COLORED ORGANOPOLYSILOXANES DYSTAR COLOURS DEUTSCHLAND GMBH (DE) 2010-01-21 — — 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 APP 2706/4885MAPT 2632/4885SNCA 264/4885

“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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