SCHEMBL15969330

SCHEMBL15969330

CNCCC1Cc2cc(O)ccc2C(C(N)=O)=C1C(N)=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.45
GLA P06280 2/20 0.45
KMT2A Q03164 2/20 0.45
GAA P10253 1/20 0.45
KDM4E B2RXH2 1/20 0.45
NPC1 O15118 1/20 0.45
NR1I2 O75469 1/20 0.45
GMNN O75496 1/20 0.45
USP2 O75604 1/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
TP53 P04637 1/20 0.45
CYP1A2 P05177 1/20 0.45
HSP90AA1 P07900 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
MAPT P10636 1/20 0.45
CYP2C9 P11712 1/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45

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
SCHEMBL15969815 0.90 MTNR1A (0.39) MEN1GLAKMT2AGAAKDM4E
SCHEMBL15969572 0.78 CYP19A1 (0.49) MEN1GLAKMT2AGAAKDM4E
SCHEMBL15969586 0.77 CYP19A1 (0.67) MEN1GLAKMT2AGAAKDM4E
SCHEMBL15969573 0.71 CYP19A1 (0.42) MEN1GLAKMT2AGAATSHR
SCHEMBL15970366 0.68 CYP19A1 (0.56) CYP19A1ESR1ESR2CYP26A1
SCHEMBL14380129 0.64 ESR1 (0.59) NQO2MTNR1AMTNR1BESR1ESR2
SCHEMBL9854906 0.63 CYP19A1 (0.53) MEN1GLAKMT2AGAAKDM4E
SCHEMBL7607920 0.63 MEN1 (1.00) MEN1GLAKMT2AGAAKDM4E
SCHEMBL7607918 0.63 MEN1 (1.00) MEN1GLAKMT2AGAAKDM4E
SCHEMBL30603072 0.63 MEN1 (1.00) MEN1GLAKMT2AGAAKDM4E

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-20140243335-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-08-28 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-20140243335-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, H1-3 MEN1 3795/4885GLA 1360/4885KMT2A 62/4885

“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.