SCHEMBL13671214

SCHEMBL13671214

C[N+](C)(C)CCSc1cc(O)c2c(c1N)C(=O)c1ccccc1C2=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.45
▸ KMT2A Q03164 6/20 0.45
▸ POLB P06746 3/20 0.45
▸ FGB P02675 1/20 0.45
▸ ADORA2A P29274 1/20 0.45
▸ MAPT P10636 4/20 0.42
▸ TDP1 Q9NUW8 3/20 0.42
▸ MAPK1 P28482 3/20 0.42
▸ HPGD P15428 2/20 0.42
▸ MAOA P21397 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ CYP1A1 P04798 2/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ DAPK1 P53355 2/20 0.42
▸ TTR P02766 2/20 0.42
▸ BRCA1 P38398 2/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ HSPD1 P10809 1/20 0.42
▸ ALOX15 P16050 1/20 0.42

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
SCHEMBL9176658 0.85 MEN1 (0.51) MEN1KMT2APOLBFGBADORA2A
SCHEMBL9620077 0.84 MEN1 (0.50) MEN1KMT2APOLBFGBADORA2A
SCHEMBL31718809 0.84 MEN1 (0.50) MEN1KMT2APOLBFGBADORA2A
SCHEMBL10609299 0.80 MEN1 (0.45) MEN1KMT2APOLBFGBADORA2A
SCHEMBL11761460 0.78 MEN1 (0.46) MEN1KMT2APOLBFGBADORA2A
SCHEMBL11762190 0.78 ADORA2A (0.48) MEN1KMT2APOLBFGBADORA2A
SCHEMBL13671208 0.78 TERT (0.44) MEN1KMT2APOLBFGBADORA2A
SCHEMBL8731432 0.76 ADORA2A (0.76) MEN1KMT2APOLBFGBADORA2A
SCHEMBL8340595 0.74 MEN1 (0.40) MEN1KMT2APOLBFGBADORA2A
SCHEMBL10017874 0.73 GNG2 (0.48) MAPK1HPGDALDH1A1CYP3A4ALOX15

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-20090249564-A1 HAIR DYE COMPOSITIONS DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2009-10-08 — — US disclosed
EP-1820826-A1 Dyestuffs and Hair Dye Compositions DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 2007-08-22 — — EP disclosed
WO-2007090800-A2 HAIR DYE COMPOSITIONS DYSTAR TEXTILFARBEN GMBH & CO DEUTSCHLAND KG (DE) 2007-08-16 — — WO 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-20090249564-A1 HAIR DYE COMPOSITIONS TYR, CDY1; CDY1B, ZYX MEN1 3258/4885KMT2A 1010/4885POLB 1992/4885

“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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