SCHEMBL8836337

SCHEMBL8836337

O=C(O)Nn1cc(Cl)c2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
NPC1 O15118 1/20 0.37
KDM4E B2RXH2 1/20 0.37
FABP4 P15090 2/20 0.37
FABP5 Q01469 2/20 0.37
RORC P51449 4/20 0.36
NOTUM Q6P988 1/20 0.36
MEN1 O00255 2/20 0.36
NR4A2 P43354 2/20 0.36
TSHR P16473 1/20 0.36
PLK1 P53350 1/20 0.35
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
POLB P06746 1/20 0.35
FABP3 P05413 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
SCHEMBL9433286 0.81 KDM4E (0.36) KMT2AALDH1A1MAPTKDM4EPOLB
SCHEMBL8835680 0.81 KDM4E (0.36) KMT2AALDH1A1MAPTKDM4EPOLB
SCHEMBL8836040 0.81 SLC6A2 (0.51) KMT2AKDM4EFABP4MEN1NR4A2
SCHEMBL9433290 0.74 KDM4E (0.41) KMT2AALDH1A1MAPTKDM4ERORC
SCHEMBL8835682 0.74 CNR1 (0.37) KMT2AALDH1A1MAPTNPC1KDM4E
SCHEMBL7675381 0.73 HTR6 (0.55) KMT2AMEN1
SCHEMBL19259501 0.70 SLC6A2 (0.50) ALDH1A1MAPTKDM4EFABP4FABP5
SCHEMBL5693076 0.68 CA1 (0.43) KMT2A
SCHEMBL29037094 0.68 NOTUM (0.62) KMT2AALDH1A1MAPTNPC1KDM4E
SCHEMBL8835790 0.68 ALDH1A1 (0.42) KMT2AALDH1A1MAPTNPC1KDM4E

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-5319096-A Neuroprotective agent HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1994-06-07 US claimed
US-5646300-A NEUROPROTECTIVE AGENTS HOECHST MARION ROUSSEL, INC. (US) 1997-07-08 US disclosed
US-5591866-A NEUROPROTECTIVE AGENTS HOECHST MARION ROUSSEL INC. (US) 1997-01-07 US disclosed
US-5565579-A NEUROPROTECTIVE AGENT HOECHST MARION ROUSSEL INC. (US) 1996-10-15 US disclosed
EP-0563916-B1 (1H-Indol-1-yl)-2-(amino)acetamides and related (1H-indol-1-yl)-(aminoalkyl)amides, intermediates and a process for their preparation and their use as medicaments HOECHST ROUSSEL PHARMA (US) 1995-08-16 EP disclosed
US-5319096-A Neuroprotective agent HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1994-06-07 US disclosed
EP-0563916-A1 (1H-Indol-1-yl)-2-(amino)acetamides and related (1H-indol-1-yl)-(aminoalkyl)amides, intermediates and a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-10-06 EP disclosed