SCHEMBL4634295

SCHEMBL4634295

O=c1c([S])c(-c2ccccc2)oc2ccccc12

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 3/20 0.66
▸ KDM4E B2RXH2 6/20 0.65
▸ CYP3A4 P08684 6/20 0.65
▸ KMT2A Q03164 5/20 0.65
▸ MEN1 O00255 4/20 0.65
▸ LMNA P02545 3/20 0.65
▸ ALOX15 P16050 2/20 0.65
▸ MAPK1 P28482 2/20 0.65
▸ CA1 P00915 2/20 0.65
▸ CA2 P00918 2/20 0.65
▸ TP53 P04637 2/20 0.65
▸ DDR2 Q16832 1/20 0.65
▸ CA12 O43570 1/20 0.65
▸ ABCB1 P08183 1/20 0.65
▸ CALM1 P0DP23 1/20 0.65
▸ AR P10275 1/20 0.65
▸ PKM P14618 1/20 0.65
▸ CYP1B1 Q16678 1/20 0.65
▸ CA9 Q16790 1/20 0.65
▸ ADORA3 P0DMS8 1/20 0.65

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
SCHEMBL29349443 0.81 KMT2A (0.69) ABCG2KDM4ECYP3A4KMT2AMEN1
SCHEMBL693914 0.81 KMT2A (0.69) ABCG2KDM4ECYP3A4KMT2AMEN1
SCHEMBL28162855 0.80 KMT2A (0.67) ABCG2KDM4ECYP3A4KMT2AMEN1
SCHEMBL28847414 0.80 KMT2A (0.67) ABCG2KDM4ECYP3A4KMT2AMEN1
SCHEMBL7703075 0.80 PLA2G2A (0.73) ABCG2KDM4ECYP3A4KMT2AMEN1
SCHEMBL4634257 0.80 KMT2A (0.67) ABCG2KDM4ECYP3A4KMT2AMEN1
SCHEMBL31717956 0.80 KMT2A (0.67) ABCG2KDM4ECYP3A4KMT2AMEN1
SCHEMBL29993383 0.79 ABCG2 (1.00) ABCG2KDM4ECYP3A4KMT2AMEN1
SCHEMBL253523 0.79 ABCG2 (1.00) ABCG2KDM4ECYP3A4KMT2AMEN1
SCHEMBL28994152 0.79 ALDH1A1 (0.70) ABCG2KDM4ECYP3A4KMT2AMEN1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7405030-B2 Imide compound and optical recording media made by using the same MITSUI CHEMICALS, INC. (JP) 2008-07-29 — — US disclosed
EP-1930339-A2 Imide compound MITSUI CHEMICALS, INC. (JP) 2008-06-11 — — EP disclosed
US-20070259151-A1 Imide compound and optical recording media made by using the same MITSUI CHEMICALS, INC. (JP) 2007-11-08 — — US disclosed
US-7259260-B2 Imide compound and optical recording media made by using the same MITSUI CHEMICALS, INC. (JP) 2007-08-21 — — US disclosed
US-20050208425-A1 Imide compound and optical recording media made by using the same YAMAMOTO CHEMICALS, INC. (JP) 2005-09-22 — — US disclosed
EP-1445115-A1 IMIDE COMPOUNDS AND OPTICAL RECORDING MEDIA MADE BY USING THE SAME Mitsui Chemicals, Inc. (JP) 2004-08-11 — — EP 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-20050208425-A1 Imide compound and optical recording media made by using the same CRY1, MTNR1A, TRPA1 ABCG2 4525/4885KDM4E 3011/4885CYP3A4 1620/4885

“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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