SCHEMBL14907833

SCHEMBL14907833

C=CC(=O)Nc1cc(CN)ccc1O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 1/20 0.46
▸ BCL2A1 Q16548 1/20 0.41
▸ GAA P10253 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ HPSE Q9Y251 1/20 0.39
▸ TGM2 P21980 2/20 0.39
▸ ZAP70 P43403 1/20 0.38
▸ THRA P10827 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ FGFR1 P11362 3/20 0.38
▸ FGFR4 P22455 3/20 0.38
▸ RORC P51449 3/20 0.38
▸ KLKB1 P03952 3/20 0.38
▸ PLG P00747 3/20 0.37
▸ KLK1 P06870 3/20 0.37
▸ KLK6 Q92876 3/20 0.37

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
SCHEMBL28043945 0.84 HDAC1 (0.41) HDAC1BCL2A1TGM2THRATHRB
SCHEMBL16139300 0.84 TRPA1 (0.46) BCL2A1GAAMAPTSMN1; SMN2HPSE
SCHEMBL28043956 0.81 TGM2 (0.39) HDAC1BCL2A1TGM2THRATHRB
SCHEMBL3870279 0.76 GAA (0.67) GAAMAPTSMN1; SMN2TGM2
SCHEMBL16653882 0.75 TGM2 (0.59) TGM2THRATHRBFGFR1FGFR4
SCHEMBL14907935 0.74 HDAC1 (0.55) HDAC1BCL2A1GAAMAPTTGM2
SCHEMBL12179321 0.73 TGM2 (0.59) TGM2
SCHEMBL14081606 0.72 ABAT (0.43) HDAC1GAAMAPT
SCHEMBL7894181 0.72 ALDH1A1 (0.65) MAPTRORC
SCHEMBL17847687 0.71 HDAC2 (0.38) HDAC1BCL2A1TGM2THRATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9174984-B2 Chemical compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2015-11-03 — — US disclosed
US-9174984-B2 Chemical compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2015-11-03 — — US disclosed
US-20140296204-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2014-10-02 — — US disclosed
US-20140296204-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2014-10-02 — — US disclosed
WO-2013062945-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2013-05-02 — — 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-20140296204-A1 CHEMICAL COMPOUNDS DNMT1, DNMT3A, DNMT3B HDAC1 441/4885BCL2A1 1067/4885GAA 1898/4885

“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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