SCHEMBL9367492

SCHEMBL9367492

Cc1cc(NC(=O)CCc2cccs2)cc(C)c1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.57
PTGS2 P35354 1/20 0.57
KMT2A Q03164 6/20 0.50
MEN1 O00255 5/20 0.50
RAB9A P51151 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.49
NPC1 O15118 3/20 0.49
APEX1 P27695 1/20 0.48
BLM P54132 2/20 0.48
CTDSP1 Q9GZU7 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
POLB P06746 3/20 0.47
ALDH1A1 P00352 1/20 0.46
ESR1 P03372 1/20 0.46
ALOX15 P16050 1/20 0.46
HTT P42858 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TP53 P04637 2/20 0.46
TSHR P16473 1/20 0.46
MAPT P10636 1/20 0.45

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
SCHEMBL10445358 0.80 MAPT (0.60) KMT2AMEN1RAB9ASMN1; SMN2NPC1
SCHEMBL13185627 0.77 RAB9A (0.57) KMT2AMEN1RAB9ASMN1; SMN2NPC1
SCHEMBL9800143 0.76 PTGS1 (0.48) PTGS1PTGS2KMT2AMEN1RAB9A
SCHEMBL13167588 0.76 LMNA (0.57) KMT2AMEN1RAB9ASMN1; SMN2NPC1
SCHEMBL27366585 0.73 MAPK1 (0.55) KMT2AMEN1RAB9ASMN1; SMN2NPC1
SCHEMBL3857134 0.72 GAA (0.47) KMT2ARAB9APOLBALDH1A1ALOX15
SCHEMBL17205660 0.72 NAMPT (0.65) KMT2AMEN1RAB9ASMN1; SMN2NPC1
SCHEMBL31453067 0.72 MAPT (0.49) KMT2AMEN1RAB9ASMN1; SMN2NPC1
SCHEMBL8607008 0.71 NAMPT (0.67) KMT2AMEN1RAB9ASMN1; SMN2NPC1
SCHEMBL8195491 0.71 USP2 (0.51) RAB9ASMN1; SMN2NPC1L3MBTL1POLB

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-0374048-B1 4-Aminophenol derivatives and processes for preparing the same TANABE SEIYAKU CO (JP) 1994-08-17 EP disclosed
US-5047555-A Antiallergens, Antiinflammatory Agents TANABE SEIYAKU CO., LTD. (JP) 1991-09-10 US disclosed