SCHEMBL11618503

SCHEMBL11618503

O=C(CCNC(=O)c1ccccc1C(=O)O)NO

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.56
APEX1 P27695 1/20 0.56
LMNA P02545 1/20 0.54
MAPT P10636 1/20 0.54
HDAC1 Q13547 7/20 0.53
HDAC8 Q9BY41 6/20 0.53
HDAC3 O15379 4/20 0.53
HDAC4 P56524 4/20 0.53
HDAC2 Q92769 4/20 0.53
HDAC10 Q969S8 4/20 0.53
HDAC11 Q96DB2 4/20 0.53
HDAC6 Q9UBN7 4/20 0.53
HDAC9 Q9UKV0 4/20 0.53
HDAC5 Q9UQL6 4/20 0.53
HDAC7 Q8WUI4 3/20 0.53
KDM4E B2RXH2 1/20 0.50
TAAR1 Q96RJ0 1/20 0.50
HTT P42858 3/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C19 P33261 1/20 0.49

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
SCHEMBL30525000 0.84 KMT2A (0.61) KMT2AAPEX1LMNAMAPTKDM4E
SCHEMBL10889755 0.84 KMT2A (0.69) KMT2AAPEX1LMNAMAPTKDM4E
Calcium SCHEMBL31224591 0.83 KMT2A (0.59) KMT2AAPEX1LMNAMAPTKDM4E
SCHEMBL11616885 0.83 KMT2A (0.59) KMT2AAPEX1LMNAMAPTHDAC7
SCHEMBL11115291 0.82 ALDH1A1 (0.56) LMNAHDAC1HDAC8HDAC3HDAC4
SCHEMBL6385721 0.81 HDAC6 (0.76) LMNAHDAC1HDAC8HDAC3HDAC4
SCHEMBL9695573 0.79 HTT (0.63) KMT2AAPEX1LMNAMAPTKDM4E
SCHEMBL5849754 0.79 HTT (0.63) KMT2AAPEX1LMNAMAPTKDM4E
SCHEMBL8655179 0.79 KMT2A (0.54) KMT2AAPEX1LMNAMAPTKDM4E
SCHEMBL11416343 0.78 KMT2A (0.59) KMT2AAPEX1LMNAMAPTHTT

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-4077998-A Phthaloyl amino acid hydroxamic acids MORTON-NORWICH PRODUCTS, INC. (US) 1978-03-07 US claimed
US-4099010-A PHTHALOYL AMINO ACID HYDROXAMIC ACIDS MORTON-NORWICH PRODUCTS, INC. (US) 1978-07-04 US disclosed
US-4077998-A Phthaloyl amino acid hydroxamic acids MORTON-NORWICH PRODUCTS, INC. (US) 1978-03-07 US disclosed