SCHEMBL7829367

SCHEMBL7829367

O=C(CCCCCc1nc2ccccc2s1)NOC(=O)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.60
HPGD P15428 5/20 0.57
POLB P06746 2/20 0.57
ATM Q13315 1/20 0.57
HTT P42858 4/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
ALOX15 P16050 1/20 0.57
RAB9A P51151 1/20 0.56
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
ALDH1A1 P00352 4/20 0.52
MAPT P10636 4/20 0.52
PKM P14618 2/20 0.51
HSD17B10 Q99714 1/20 0.51
KDM4E B2RXH2 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
KLF5 Q13887 1/20 0.48

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
SCHEMBL7829961 1.00 LMNA (0.60) LMNAHPGDPOLBATMHTT
SCHEMBL7829044 0.86 LMNA (0.59) LMNAHPGDPOLBATMHTT
SCHEMBL7833276 0.84 LMNA (0.57) LMNAHPGDPOLBATMHTT
SCHEMBL7820871 0.82 LMNA (0.49) LMNAHPGDPOLBATMHTT
SCHEMBL7829459 0.81 LMNA (0.67) LMNAHPGDPOLBATMHTT
SCHEMBL7829947 0.81 LMNA (0.67) LMNAHPGDPOLBATMHTT
SCHEMBL12046948 0.80 LMNA (0.68) LMNAHPGDPOLBATMHTT
SCHEMBL7835431 0.79 SMN1; SMN2 (0.89) LMNAHPGDPOLBATMHTT
SCHEMBL4700801 0.79 HTT (0.69) LMNAHPGDPOLBATMHTT
SCHEMBL7835167 0.79 SMN1; SMN2 (0.89) LMNAHPGDPOLBATMHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0737671-B1 Aromatic hydroxamic acid compounds, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-12-12 EP disclosed
EP-0737671-A2 Aromatic hydroxamic acid compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1996-10-16 EP disclosed