SCHEMBL2409487

SCHEMBL2409487

CC(C)(C)[S@@+]([O-])/N=C/c1ccc(C(=O)O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.51
CA2 P00918 3/20 0.50
CA1 P00915 2/20 0.50
MAPT P10636 5/20 0.48
SMN1; SMN2 Q16637 3/20 0.47
MEN1 O00255 2/20 0.47
MITF O75030 2/20 0.47
HPGD P15428 2/20 0.47
GAA P10253 1/20 0.47
GLA P06280 2/20 0.44
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 4/20 0.43
TDP1 Q9NUW8 2/20 0.41
POLB P06746 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
PKM P14618 1/20 0.40
TP53 P04637 2/20 0.39

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
SCHEMBL2409048 1.00 KMT2A (0.51) KMT2ACA2CA1MAPTSMN1; SMN2
SCHEMBL2411565 1.00 KMT2A (0.51) KMT2ACA2CA1MAPTSMN1; SMN2
SCHEMBL2409042 1.00 KMT2A (0.51) KMT2ACA2CA1MAPTSMN1; SMN2
SCHEMBL2409493 1.00 KMT2A (0.51) KMT2ACA2CA1MAPTSMN1; SMN2
SCHEMBL2409046 1.00 KMT2A (0.51) KMT2ACA2CA1MAPTSMN1; SMN2
SCHEMBL25896990 0.87 CA1 (0.37) KMT2ACA2CA1MAPTSMN1; SMN2
SCHEMBL26045346 0.87 CA1 (0.37) KMT2ACA2CA1MAPTSMN1; SMN2
SCHEMBL17909507 0.83 CA1 (0.53) CA2CA1MAPTSMN1; SMN2KDM4E
SCHEMBL2232451 0.83 CA1 (0.53) CA2CA1MAPTSMN1; SMN2KDM4E
SCHEMBL2232449 0.83 CA1 (0.53) CA2CA1MAPTSMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9382197-B2 Substituted hydroxamic acids and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2016-07-05 US disclosed
US-20140275093-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-09-18 US disclosed
US-20110212969-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-09-01 US disclosed
WO-2011106632-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-09-01 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 (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-20140275093-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC10, HDAC1 KMT2A 137/4885CA2 308/4885CA1 310/4885
US-20110212969-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC10, HDAC1 KMT2A 137/4885CA2 308/4885CA1 310/4885

“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.