SCHEMBL8788698

SCHEMBL8788698

c1cc(Nc2ccc3ccsc3c2)ccn1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.53
KDM4E B2RXH2 2/20 0.53
MEN1 O00255 2/20 0.53
BUB1 O43683 2/20 0.46
RAD52 P43351 1/20 0.44
NPC1 O15118 3/20 0.36
MAPT P10636 3/20 0.36
RAB9A P51151 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
VCP P55072 1/20 0.36
ESR1 P03372 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
POLB P06746 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
PDE4B Q07343 1/20 0.35
PDE7A Q13946 1/20 0.35
ALDH1A1 P00352 2/20 0.35
CYP3A4 P08684 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL8788576 0.86 KMT2A (0.53) KMT2AKDM4EMEN1BUB1RAD52
SCHEMBL19660760 0.82 ALDH1A1 (0.55) KMT2AKDM4EMEN1MAPTL3MBTL1
SCHEMBL29433439 0.72 CYP2A6 (0.37) KMT2AKDM4EMEN1BUB1NPC1
SCHEMBL4187399 0.72 APP (0.38) KMT2AKDM4EMEN1BUB1NPC1
SCHEMBL28702492 0.72 CYP2A6 (0.37) KMT2AKDM4EMEN1BUB1NPC1
SCHEMBL28365072 0.71 ALDH1A1 (0.70) KMT2AKDM4EMEN1RAD52NPC1
SCHEMBL20712207 0.70 KMT2A (0.50) KMT2AKDM4EMEN1RAD52NPC1
SCHEMBL725063 0.69 RAD52 (0.70) KMT2AKDM4EMEN1RAD52MAPT
SCHEMBL25262011 0.69 KMT2A (0.68) KMT2AKDM4EMEN1RAD52NPC1
SCHEMBL31114573 0.69 KMT2A (0.68) KMT2AKDM4EMEN1RAD52NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0534343-B1 Substituted pyridinylamino-1H-indoles, 1H-indazoles, 2H-indazoles, benzo(b) thiophenes and 1,2-benzisothiazoles, a process for their preparation and their use as medicaments HOECHST MARION ROUSSEL INC (US) 1997-11-19 EP disclosed
US-5631270-A COGNITION ACTIVATORS HOECHST MARION ROUSSEL, INC. (US) 1997-05-20 US disclosed
US-5424322-A Substituted pyridinylamino-1h-indole derivatives HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1995-06-13 US disclosed
US-5328918-A Psychological disorders, antiinflammatory agent HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1994-07-12 US disclosed
US-5246947-A Substituted pyridinylamino-1,2-benzisothiazoles and their use for treating depression HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-09-21 US disclosed
US-5229401-A Cognition activators; Alzheimer's disease; psychological disorders,e.g obsessive-compulsive; antidepressants; topical antinflammatory agent; skin disorders HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-07-20 US disclosed
EP-0534343-A1 Substituted pyridinylamino-1H-indoles, 1H-indazoles, 2H-indazoles, benzo(b) thiophenes and 1,2-benzisothiazoles, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-03-31 EP disclosed
US-5185350-A For Alzheimer*s, memory dysfunctions, antidepressants, antiinflammatory agents HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-02-09 US disclosed