SCHEMBL16091765

SCHEMBL16091765

CCCc1cc(C)c2ncoc2c1N

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.37
▸ ALDH1A1 P00352 4/20 0.37
▸ NOS2 P35228 3/20 0.34
▸ HPGD P15428 2/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ TLR8 Q9NR97 1/20 0.33
▸ NOS3 P29474 2/20 0.33
▸ NOS1 P29475 2/20 0.33
▸ TSHR P16473 2/20 0.32
▸ POLB P06746 2/20 0.32
▸ IKBKB O14920 1/20 0.31

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
SCHEMBL16091776 0.90 TLR8 (0.34) KDM4EALDH1A1NOS2HPGDHSD17B10
SCHEMBL15629820 0.86 NOS3 (0.42) KDM4EALDH1A1NOS2HSD17B10NOS3
SCHEMBL23839498 0.78 MTNR1A (0.34) KDM4EALDH1A1NOS2HPGDHSD17B10
SCHEMBL15629846 0.77 NOS3 (0.40) ALDH1A1NOS2NOS3NOS1POLB
SCHEMBL16091748 0.72 NOS2 (0.37) KDM4EALDH1A1NOS2HPGDHSD17B10
SCHEMBL16091768 0.71 KDM4E (0.35) KDM4EALDH1A1NOS2NOS3NOS1
SCHEMBL15629824 0.69 POLB (0.34) NOS2NOS3NOS1POLB
SCHEMBL16091762 0.69 TLR8 (0.35) KDM4EALDH1A1NOS2HPGDHSD17B10
SCHEMBL3801326 0.69 SKP2 (0.37) KDM4EALDH1A1NOS2HPGDHSD17B10
SCHEMBL15339532 0.69 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140274918-A1 METHOD FOR DUAL INHIBITION OF SGLT1 AND SGLT2 USING DIPHENYLMETHANE DERIVATIVES GREEN CROSS CORPORATION (KR) 2014-09-18 — — 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-20140274918-A1 METHOD FOR DUAL INHIBITION OF SGLT1 AND SGLT2 USING DIPHENYLMETHANE DERIVATIVES SLC5A2, SLC5A1, SLC10A2 KDM4E 767/4885ALDH1A1 691/4885NOS2 2904/4885

“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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