SCHEMBL346347

SCHEMBL346347

O=C(NO)C1CCc2cc(NC(=O)[C@H]3Cc4ccccc4CN3)ccc2C1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 10/20 0.48
KMT2A Q03164 4/20 0.48
POLB P06746 1/20 0.47
GHSR Q92847 1/20 0.46
MEN1 O00255 1/20 0.41
ROCK2 O75116 1/20 0.41

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
SCHEMBL10197864 1.00 HDAC8 (0.48) HDAC8KMT2APOLBGHSRMEN1
SCHEMBL436877 0.82 PSMB8 (0.48) HDAC8KMT2AGHSR
SCHEMBL346517 0.81 GHSR (0.49) KMT2AGHSRMEN1
SCHEMBL27470508 0.77 KMT2A (0.57) HDAC8KMT2APOLBMEN1
SCHEMBL346641 0.76 GHSR (0.49) KMT2AGHSRMEN1
SCHEMBL366547 0.75 P2RX7 (0.55) GHSR
SCHEMBL435892 0.75 ULK1 (0.51) KMT2AGHSRROCK2
SCHEMBL345545 0.75 NPC1 (0.59) KMT2APOLBGHSRMEN1
SCHEMBL436770 0.75 ULK1 (0.46) KMT2AGHSRMEN1
Hydrochloric Acid SCHEMBL4786867 0.74 HDAC8 (0.61) HDAC8KMT2APOLBMEN1

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-20140243334-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-08-28 US disclosed
WO-2012012320-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENIUM PHARMACEUTICALS, INC. (US) 2012-01-26 WO disclosed
US-20120015942-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-01-19 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 (2 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-20120015942-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, HDAC2 HDAC8 13/4885KMT2A 41/4885POLB 422/4885
US-20140243334-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF HDAC6, H1-3, H1-5 HDAC8 19/4885KMT2A 60/4885POLB 648/4885

“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.