SCHEMBL7735271

SCHEMBL7735271

OCC#Cc1cc(Cl)cc2nc(-c3cccc(Cl)c3)oc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.41
IKBKB O14920 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
CASP3 P42574 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
TP53 P04637 3/20 0.39
NPC1 O15118 1/20 0.39
TSHR P16473 1/20 0.39
NFKB1 P19838 1/20 0.39
RAB9A P51151 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
ALOX15 P16050 1/20 0.39
P2RY14 Q15391 1/20 0.39
ESR1 P03372 3/20 0.38
ESR2 Q92731 3/20 0.38
THRB P10828 1/20 0.38
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL7734276 0.82 NPC1 (0.42) MAOBIKBKBSMN1; SMN2CASP3SENP7
SCHEMBL7733971 0.81 MAPT (0.46) SMN1; SMN2TP53NPC1TSHRRAB9A
SCHEMBL7735654 0.79 NPC1 (0.42) TP53NPC1RAB9ALMNAMAPT
SCHEMBL7737446 0.76 PGK1 (0.35) ALDH1A1
SCHEMBL7734319 0.74 AKR1B1 (0.34) NPC1TSHRRAB9AMAPTALDH1A1
SCHEMBL7733884 0.74 MAOB (0.48) MAOBIKBKBSMN1; SMN2CASP3SENP7
SCHEMBL7737473 0.74 MEN1 (0.39) SMN1; SMN2TP53NPC1TSHRRAB9A
SCHEMBL7737479 0.74 PDE4A (0.45)
SCHEMBL7733881 0.73 NLRP3 (0.36) TSHRLMNAMAPTKDM4EALDH1A1
SCHEMBL7737540 0.72 MAPT (0.44) SMN1; SMN2TP53NPC1TSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6372770-B1 TREATING A MAMMAL SUFFERING FROM A DISEASE STATE SELECTED FROM THE GROUP CONSISTING OF ASTHMA, ALLERGIES, INFLAMMATION, DEPRESSION, DEMENTIA, ATOPIC DISEASES, RHINITIS AND DISEASE STATES ASSOCIATED WITH ABNORMALLY HIGH PHYSIOLOGICAL LEVELS OF EURO-CELTIQUE, S.A. 2002-04-16 US disclosed
EP-0785927-A4 NOVEL BENZOXAZOLES EURO CELTIQUE SA (LU) 1997-12-29 EP disclosed
EP-0785927-A1 NOVEL BENZOXAZOLES Euroceltique S.A. (LU) 1997-07-30 EP disclosed
WO-1996011917-A1 NOVEL BENZOXAZOLES EURO-CELTIQUE, S.A. (LU) 1996-04-25 WO disclosed