SCHEMBL7559906

SCHEMBL7559906

C[C@H](C(=O)NO)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.63
HDAC4 P56524 1/20 0.63
HDAC1 Q13547 1/20 0.63
HDAC7 Q8WUI4 1/20 0.63
HDAC2 Q92769 1/20 0.63
HDAC10 Q969S8 1/20 0.63
HDAC11 Q96DB2 1/20 0.63
HDAC8 Q9BY41 1/20 0.63
HDAC6 Q9UBN7 1/20 0.63
HDAC9 Q9UKV0 1/20 0.63
HDAC5 Q9UQL6 1/20 0.63
CHRM1 P11229 1/20 0.59
PDE4A P27815 1/20 0.59
GRM7 Q14831 2/20 0.54
POLB P06746 1/20 0.54
MMP8 P22894 3/20 0.51
MMP9 P14780 3/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
LMNA P02545 1/20 0.50

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
SCHEMBL4729281 1.00 HDAC3 (0.63) HDAC3HDAC4HDAC1HDAC7HDAC2
Benzoic Acid SCHEMBL28031924 0.91 HDAC1 (0.53) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL3135701 0.83 LMNA (0.55) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL2055558 0.83 LMNA (0.55) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL2055561 0.83 LMNA (0.55) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL6904220 0.82 GRM7 (0.50) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL15522550 0.81 CHRM1 (0.62) HDAC1HDAC2HDAC8CHRM1PDE4A
SCHEMBL9848999 0.81 GRM7 (0.53) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL18885406 0.81 GPR88 (0.53) GRM7POLBMEN1KMT2ALMNA
SCHEMBL13712793 0.81 CHRM1 (0.62) HDAC3HDAC4HDAC1HDAC7HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0935669-B1 ENZYMATIC SYNTHESIS OF OPTICALLY ACTIVE HYDROXAMIC ACIDS AND THEIR CONVERSION INTO OPTICALLY ACTIVE PRIMARY AMINES BY LOSSEN TRANSPOSITION FRAUNHOFER GES FORSCHUNG (DE) 2002-07-31 EP disclosed
US-6350902-B2 REACTING HYDROXYAMINE WITH A TRIFLUOROFORMATE ESTER ABBOTT LABORATORIES 2002-02-26 US disclosed
US-20020002307-A1 Process for the selective N-formylation of N-hydroxylamines ABBOTT LABORATORIES 2002-01-03 US disclosed
US-20010031896-A1 Process for the selective N-formylation of N-hydroxylamines ABBOTT LABORATORIES 2001-10-18 US disclosed
US-6281003-B1 REACTING RACEMIC AMIDE, CARBOXYLIC ACID OR ESTER WITH HYDROXYLAMINE FRAUNHOFER-GESELLSCHAFT ZUR FORDERUNG DER ANGEWANDTEN FORSCHUNG E. V. (DE) 2001-08-28 US disclosed
EP-0935669-A1 ENZYMATIC SYNTHESIS OF OPTICALLY ACTIVE HYDROXAMIC ACIDS AND THEIR CONVERSION INTO OPTICALLY ACTIVE PRIMARY AMINES BY LOSSEN TRANSPOSITION FRAUNHOFER-GESELLSCHAFT ZUR FÖRDERUNG DER ANGEWANDTEN FORSCHUNG E.V. (DE) 1999-08-18 EP disclosed
WO-1997044480-A1 ENZYMATIC SYNTHESIS OF OPTICALLY ACTIVE HYDROXAMIC ACIDS AND THEIR CONVERSION INTO OPTICALLY ACTIVE PRIMARY AMINES BY LOSSEN TRANSPOSITION Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 1997-11-27 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-20010031896-A1 Process for the selective N-formylation of N-hydroxylamines HNMT, INMT, PNMT HDAC3 2019/4885HDAC4 1233/4885HDAC1 3402/4885
US-20020002307-A1 Process for the selective N-formylation of N-hydroxylamines HNMT, INMT, PNMT HDAC3 2019/4885HDAC4 1233/4885HDAC1 3402/4885

“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.