SCHEMBL1491489

SCHEMBL1491489

COc1ccc2[nH]c3c(c2c1)CCN(C(=O)CCCCCCC(=O)NO)C3C(=O)N[C@H](C(=O)O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAPKAPK2 P49137 3/20 0.47
▸ TP53 P04637 4/20 0.46
▸ MAPT P10636 2/20 0.46
▸ HDAC1 Q13547 10/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ ABCG2 Q9UNQ0 1/20 0.43
▸ KIF11 P52732 1/20 0.43
▸ HDAC6 Q9UBN7 2/20 0.42
▸ LMNA P02545 1/20 0.40
▸ MTNR1A P48039 1/20 0.40
▸ MTNR1B P49286 1/20 0.40

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
SCHEMBL1491493 1.00 MAPKAPK2 (0.47) MAPKAPK2TP53MAPTHDAC1SMN1; SMN2
SCHEMBL12673048 0.95 MAPKAPK2 (0.47) MAPKAPK2TP53MAPTHDAC1SMN1; SMN2
SCHEMBL1491342 0.91 TP53 (0.46) MAPKAPK2TP53MAPTHDAC1SMN1; SMN2
SCHEMBL1491340 0.91 TP53 (0.46) MAPKAPK2TP53MAPTHDAC1SMN1; SMN2
SCHEMBL1491430 0.89 HDAC1 (0.54) TP53MAPTHDAC1ABCG2KIF11
SCHEMBL1491428 0.89 HDAC1 (0.54) TP53MAPTHDAC1ABCG2KIF11
SCHEMBL14930036 0.86 HDAC1 (0.51) TP53HDAC1ABCG2HDAC6LMNA
SCHEMBL12831409 0.81 TP53 (0.51) MAPKAPK2TP53MAPTHDAC1SMN1; SMN2
SCHEMBL1491400 0.80 HDAC1 (0.48) TP53MAPTHDAC1ABCG2HDAC6
SCHEMBL1491403 0.80 HDAC1 (0.48) TP53MAPTHDAC1ABCG2HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9133104-B2 Enzyme inhibitors CHROMA THERAPEUTICS LTD. (GB) 2015-09-15 — — US disclosed
US-20140163042-A1 ENZYME INHIBITORS CHROMA THERAPEUTICS LTD. (GB) 2014-06-12 — — US disclosed
US-20130116318-A1 Enzyme Inhibitors CHROMA THERAPEUTICS LTD. (GB) 2013-05-09 — — US disclosed
US-7939666-B2 Enzyme inhibitors CHROMA THERAPEUTICS LTD. (GB) 2011-05-10 — — US disclosed
EP-2301939-A1 Enzyme inhibitors Chroma Therapeutics Limited (GB) 2011-03-30 — — EP disclosed
US-20090291978-A1 Enzyme Inhibitors CHROMA THERAPEUTICS LTD. (GB) 2009-11-26 — — US disclosed
EP-1879895-A1 ENZYME INHIBITORS Chroma Therapeutics Limited (GB) 2008-01-23 — — EP disclosed
WO-2006117549-A1 ENZYME INHIBITORS CHROMA THERAPEUTICS LTD (GB) 2006-11-09 — — 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 (3 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-20130116318-A1 Enzyme Inhibitors HDAC1, HDAC11, HDAC7 MAPKAPK2 2180/4885TP53 342/4885MAPT 3276/4885
US-20140163042-A1 ENZYME INHIBITORS HAT1, NR2E1, HDAC3 MAPKAPK2 4562/4885TP53 1898/4885MAPT 4835/4885
US-20090291978-A1 Enzyme Inhibitors HAT1, NR2E1, NR2C2 MAPKAPK2 1644/4885TP53 2646/4885MAPT 4873/4885

“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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