SCHEMBL8880732

SCHEMBL8880732

COc1ccc(C(=O)c2cccn2N2C(=O)c3ccccc3C2=O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.51
GAA P10253 1/20 0.47
KMT2A Q03164 2/20 0.46
RAB9A P51151 4/20 0.45
MAPT P10636 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
KDM4E B2RXH2 1/20 0.45
MAPK1 P28482 1/20 0.45
HKDC1 Q2TB90 1/20 0.45
HSP90AA1 P07900 1/20 0.44
ALDH1A1 P00352 1/20 0.43
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
MEN1 O00255 1/20 0.42
APAF1 O14727 1/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL8446968 0.84 ALDH1A1 (0.47) KMT2AMAPTNPSR1HKDC1ALDH1A1
SCHEMBL9467507 0.79 KMT2A (0.45) NPC1GAAKMT2ARAB9AMAPT
SCHEMBL1966590 0.77 POLB (0.45) KMT2AMAPTMAPK1ALDH1A1HTT
SCHEMBL8305666 0.75 POLB (0.48) KMT2AKDM4EHSP90AA1ALDH1A1MEN1
SCHEMBL8540702 0.75 KEAP1 (0.42) NPC1GAAKMT2ARAB9AMAPT
SCHEMBL6957332 0.74 RAB9A (0.50) NPC1KMT2ARAB9AMAPTNPSR1
SCHEMBL8877807 0.73 POLB (0.37) GAAKMT2ARAB9AMAPTKDM4E
SCHEMBL8880208 0.73 CA1 (0.50) NPC1GAAKMT2ARAB9AMAPT
SCHEMBL8307356 0.73 GRM1 (0.42) NPC1GAAKMT2ARAB9AMAPT
SCHEMBL10365839 0.72 CNR2 (0.44) KMT2ARAB9AMAPTKDM4EHSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5274116-A 1-aminoacetamidopyrroles and 1-aminoacetamido-2-(substituted)pyrroles and related compounds HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1993-12-28 US claimed
US-5605925-A COGNITION ACTIVATOR; ALZHEIMER'S DISEASE HOECHST MARION ROUSSEL, INC. (US) 1997-02-25 US disclosed
US-5580987-A TREATING 1-PHTHALIMIDOPYRROLE WITH BASE TO YIELD 1-AMINOPYRROLE, REACTING WITH SUBSTITUTED AMINO ACID TO OBTAIN DESIRED COMPOUND HOECHST MARION ROUSSEL, INC. (US) 1996-12-03 US disclosed
US-5576446-A GLYCINE PARTIAL AGONIST AND ENHANCEMENT OF LEARNING AND MEMORY, TREATMENT OF ALZHEIMER'S HOECHST MARION ROUSSEL, INC. (US) 1996-11-19 US disclosed
US-5428053-A Treats alzheimer's disease and other senile dementias HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1995-06-27 US disclosed
EP-0582182-A1 1-Aminoacetamidopyrroles and 1-amino-2-(substituted) pyrroles and their use for the treatment of neurodegenerative dysfunctions HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1994-02-09 EP disclosed
US-5274116-A 1-aminoacetamidopyrroles and 1-aminoacetamido-2-(substituted)pyrroles and related compounds HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1993-12-28 US disclosed