SCHEMBL8630410

SCHEMBL8630410

Clc1ccc(-n2[c]nnn2)c(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.43
NOTUM Q6P988 1/20 0.40
TLR8 Q9NR97 2/20 0.38
LMNA P02545 4/20 0.37
MEN1 O00255 2/20 0.37
MAPT P10636 2/20 0.37
KMT2A Q03164 2/20 0.37
NPC1 O15118 1/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HTT P42858 2/20 0.36
TP53 P04637 1/20 0.35
ALOX12 P18054 2/20 0.34
KDM4E B2RXH2 1/20 0.34
HCAR1 Q9BXC0 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33
RPA1 P27694 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A3 Q01959 1/20 0.33

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
SCHEMBL5128093 0.78 BCHE (0.38) NOTUMLMNAMEN1KMT2AHTT
SCHEMBL15286666 0.71 NOTUM (0.40) L3MBTL1NOTUMTLR8LMNAMEN1
SCHEMBL5120604 0.71 NOTUM (0.45) L3MBTL1NOTUMLMNAMEN1MAPT
SCHEMBL5542959 0.68 NOTUM (0.40) NOTUM
SCHEMBL11117017 0.66 NOTUM (0.56) L3MBTL1NOTUMMEN1KMT2AKDM4E
SCHEMBL2092013 0.64 L3MBTL1 (0.36) L3MBTL1NOTUMTLR8LMNAMEN1
SCHEMBL28463382 0.63 L3MBTL1 (0.60) L3MBTL1NOTUMLMNAMEN1MAPT
SCHEMBL8656100 0.63 L3MBTL1 (0.60) L3MBTL1NOTUMLMNAKMT2AALOX12
SCHEMBL30620395 0.63 L3MBTL1 (0.60) L3MBTL1NOTUMLMNAKMT2AALOX12
SCHEMBL4473341 0.63 MGLL (0.37) MAPTNPC1HCAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE35754-E FOR TREATING BACTERIAL INFECTIONS HOECHST AKTIENGESELLSCHAFT (DE) 1998-03-24 US disclosed
US-5710146-A ANTIBIOTICS FOR BACTERICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1998-01-20 US disclosed
US-5089490-A Cephem derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1992-02-18 US disclosed
US-4758556-A Cephem derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1988-07-19 US disclosed
US-4399131-A Cephem derivatives HOECHST AG (DE) 1983-08-16 US disclosed
US-4278793-A ANTIBIOTICS, BACTERICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1981-07-14 US disclosed