SCHEMBL2428494

SCHEMBL2428494

O=C1NC(=O)C(=Cc2ccc[nH]c2=O)S1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 3/20 0.60
▸ IGF1R P08069 2/20 0.60
▸ NAT1 P18440 1/20 0.60
▸ MEN1 O00255 3/20 0.57
▸ KMT2A Q03164 3/20 0.57
▸ AKR1B1 P15121 2/20 0.57
▸ GSK3B P49841 2/20 0.56
▸ PIM1 P11309 7/20 0.56
▸ PIM2 Q9P1W9 7/20 0.56
▸ PIM3 Q86V86 2/20 0.56
▸ TDP2 O95551 1/20 0.55
▸ CASP7 P55210 1/20 0.55
▸ CASP9 P55211 1/20 0.55
▸ CASP6 P55212 1/20 0.55
▸ CASP8 Q14790 1/20 0.55
▸ CISD1 Q9NZ45 1/20 0.52
▸ HPGD P15428 2/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50

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
SCHEMBL2428491 1.00 TTR (0.60) TTRIGF1RNAT1MEN1KMT2A
SCHEMBL2428488 1.00 TTR (0.60) TTRIGF1RNAT1MEN1KMT2A
SCHEMBL6651682 0.77 TTR (0.69) TTRIGF1RNAT1MEN1KMT2A
SCHEMBL6651680 0.77 TTR (0.69) TTRIGF1RNAT1MEN1KMT2A
SCHEMBL8686801 0.76 TTR (0.63) TTRIGF1RNAT1MEN1KMT2A
SCHEMBL8685078 0.76 TTR (0.63) TTRIGF1RNAT1MEN1KMT2A
SCHEMBL1250148 0.75 TTR (0.67) TTRIGF1RNAT1MEN1KMT2A
SCHEMBL1249157 0.75 NAT1 (1.00) TTRIGF1RNAT1MEN1KMT2A
SCHEMBL3939871 0.75 TTR (0.67) TTRIGF1RNAT1MEN1KMT2A
SCHEMBL7985096 0.75 NAT1 (1.00) TTRIGF1RNAT1MEN1KMT2A

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-20150051185-A1 Chemical Compounds 251 ASTRAZENECA AB (SE) 2015-02-19 — — US disclosed
US-8901307-B2 Chemical compounds 251 ASTRAZENECA AB (SE) 2014-12-02 — — US disclosed
US-20110218182-A1 CHEMICAL COMPOUNDS 251 ASTRAZENECA AB (SE) 2011-09-08 — — 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 (2 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-20110218182-A1 CHEMICAL COMPOUNDS 251 PIM1, PIM3, PIM2 TTR 3895/4885IGF1R 216/4885NAT1 625/4885
US-20150051185-A1 Chemical Compounds 251 PIM1, PIM3, PIM2 TTR 4032/4885IGF1R 291/4885NAT1 783/4885

“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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