SCHEMBL8843451

SCHEMBL8843451

CC(=O)NNCc1ccc(-c2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.51
ALDH1A1 P00352 2/20 0.51
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
FFAR1 O14842 3/20 0.49
EPHX2 P34913 1/20 0.49
NR1H4 Q96RI1 1/20 0.49
ABCC4 O15439 1/20 0.48
GAA P10253 1/20 0.48
TSHR P16473 1/20 0.48
PTGS1 P23219 1/20 0.48
HTT P42858 1/20 0.48
HDAC1 Q13547 3/20 0.48
HDAC3 O15379 2/20 0.47
HDAC4 P56524 2/20 0.47
HDAC2 Q92769 2/20 0.47
HDAC11 Q96DB2 2/20 0.47
HDAC8 Q9BY41 2/20 0.47

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
SCHEMBL4418820 0.89 LMNA (0.51) LMNAALDH1A1NPC1RAB9AGAA
SCHEMBL5801663 0.81 KMT2A (0.65) LMNAALDH1A1MEN1KMT2ANPC1
SCHEMBL9697869 0.81 ESRRG (0.56) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL7392747 0.80 ACACB (0.48) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL8340802 0.79 SMN1; SMN2 (0.50) LMNAALDH1A1MEN1KMT2ANPC1
SCHEMBL8338354 0.78 MEN1 (0.55) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL8338756 0.78 LMNA (0.49) LMNAALDH1A1KMT2ANPC1RAB9A
SCHEMBL27959104 0.78 PTPN1 (0.47) LMNAALDH1A1NPC1RAB9AGAA
SCHEMBL6447258 0.78 HDAC1 (0.52) LMNAALDH1A1MEN1KMT2ANPC1
SCHEMBL9937386 0.75 SMN1; SMN2 (0.47) LMNAALDH1A1NPC1RAB9AGAA

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-5672615-A MATRIX-DEGRADING METALLOPROTEINASE INHIBITORS NOVARTIS CORPORATION (US) 1997-09-30 US disclosed