SCHEMBL8103183

SCHEMBL8103183

Cc1ccc(NC(=O)NN(O)C(=O)CC(C)O)cc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.44
POLB P06746 3/20 0.44
MAPT P10636 5/20 0.43
RAB9A P51151 4/20 0.42
ALDH1A1 P00352 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
TDP1 Q9NUW8 2/20 0.41
CASR P41180 1/20 0.41
PPARG P37231 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
NR2E3 Q9Y5X4 1/20 0.40
NCOR2 Q9Y618 1/20 0.40
PTPN7 P35236 1/20 0.40
IDO1 P14902 1/20 0.39

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
SCHEMBL7411164 0.90 NPC1 (0.45) NPC1POLBMAPTRAB9AALDH1A1
SCHEMBL27519085 0.75 PLG (0.41) NPC1RAB9ASMN1; SMN2
SCHEMBL7413034 0.75 RAB9A (0.43) NPC1POLBMAPTRAB9AALDH1A1
SCHEMBL12994633 0.72 NPC1 (0.60) NPC1POLBMAPTRAB9AALDH1A1
SCHEMBL13102959 0.71 RAB9A (0.59) NPC1POLBMAPTRAB9AALDH1A1
SCHEMBL1275920 0.70 ALDH1A1 (0.70) NPC1POLBMAPTRAB9AALDH1A1
SCHEMBL17169067 0.69 IDO1 (0.42) NPC1POLBMAPTRAB9AALDH1A1
SCHEMBL5851828 0.68 CA12 (0.62) NPC1POLBMAPTRAB9AALDH1A1
SCHEMBL28904427 0.67 RAB9A (0.54) NPC1POLBMAPTRAB9AALDH1A1
SCHEMBL21597432 0.67 TDP1 (0.59) NPC1POLBMAPTRAB9AALDH1A1

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-1009737-A2 SULFONYLAMINO SUBSTITUTED HYDROXAMIC ACID DERIVATIVES AS METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2000-06-21 EP disclosed
WO-1999006340-A2 SULFONYLAMINO SUBSTITUTED HYDROXAMIC ACID DERIVATIVES AS METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 1999-02-11 WO disclosed