SCHEMBL4880512

SCHEMBL4880512

CC(=CNC(=O)c1ccccc1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.50
RAB9A P51151 6/20 0.50
KDM4E B2RXH2 3/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
ALDH1A1 P00352 2/20 0.49
MAPT P10636 2/20 0.49
GLA P06280 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
AKR1C3 P42330 1/20 0.47
HDAC3 O15379 1/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
IDO1 P14902 1/20 0.47
ALOX15 P16050 1/20 0.47
HDAC1 Q13547 1/20 0.47
CA9 Q16790 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC2 Q92769 1/20 0.47
HSD17B10 Q99714 1/20 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
SCHEMBL9659781 0.84 NPC1 (0.53) NPC1RAB9AKDM4EMEN1KMT2A
SCHEMBL11532039 0.83 ALDH1A1 (0.49) NPC1RAB9AKDM4EMEN1KMT2A
SCHEMBL29289515 0.77 RAB9A (0.46) NPC1RAB9AKDM4EMEN1KMT2A
SCHEMBL1002786 0.76 HPGD (0.67) NPC1RAB9AKDM4EMEN1KMT2A
SCHEMBL497521 0.75 NPC1 (0.57) NPC1RAB9AKDM4EMEN1KMT2A
SCHEMBL289886 0.75 NPC1 (0.57) NPC1RAB9AKDM4EMEN1KMT2A
SCHEMBL14846419 0.75 ALDH1A1 (0.49) NPC1RAB9AKDM4EMEN1KMT2A
Hydrochloric Acid SCHEMBL5405389 0.73 NPC1 (0.50) NPC1RAB9AKMT2AALDH1A1MAPT
SCHEMBL554490 0.73 RAB9A (0.59) NPC1RAB9AKDM4EMEN1KMT2A
SCHEMBL10841553 0.73 NPC1 (0.59) NPC1RAB9AKDM4EMEN1KMT2A

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
US-20080058235-A1 Lubricative Composition for Industrial Machinery and Equipment NIPPON OIL CORPORATION (JP) 2008-03-06 US disclosed
EP-1734103-A1 LUBRICATING OIL COMPOSITION FOR INDUSTRIAL MACHINERY AND EQUIPMENT Nippon Oil Corporation (JP) 2006-12-20 EP disclosed