SCHEMBL6131343

SCHEMBL6131343

CC1=Cc2ccccc2C1(c1cccc2cccnc12)[Cr](Cl)Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.36
KDM4E B2RXH2 5/20 0.36
TDP1 Q9NUW8 5/20 0.36
KMT2A Q03164 5/20 0.36
MEN1 O00255 4/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
ALDH1A1 P00352 3/20 0.36
NPC1 O15118 2/20 0.36
POLB P06746 2/20 0.36
RAB9A P51151 2/20 0.36
THRB P10828 1/20 0.36
RECQL P46063 1/20 0.36
GAA P10253 2/20 0.35
APOBEC3G Q9HC16 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
LMNA P02545 4/20 0.35
CCR1 P32246 3/20 0.35
CCR5 P51681 3/20 0.35
CCR8 P51685 3/20 0.35
HTT P42858 3/20 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
SCHEMBL6055552 0.79 MAPT (0.40) MAPTKDM4ETDP1KMT2AMEN1
Hydrochloric Acid SCHEMBL1071467 0.76 MAPT (0.37) MAPTKDM4ETDP1KMT2AMEN1
SCHEMBL26134606 0.73 CCR1 (0.35) MAPTKDM4ETDP1KMT2AMEN1
SCHEMBL6131341 0.71 KDM4E (0.38) MAPTKDM4ETDP1KMT2AMEN1
Hydrochloric Acid SCHEMBL4452823 0.68 MAPT (0.38) MAPTKDM4ETDP1KMT2AMEN1
Hydrochloric Acid SCHEMBL1071823 0.68 MAPT (0.37) MAPTKDM4ETDP1KMT2AMEN1
Hydrochloric Acid SCHEMBL1685838 0.66 ESR1 (0.35) MAPTKDM4ETDP1ALDH1A1RAB9A
Hydrochloric Acid SCHEMBL1072266 0.66 PSMD14 (0.37) MAPTKDM4ETDP1KMT2AMEN1
Hydrochloric Acid SCHEMBL1070024 0.65 MAPT (0.36) MAPTKDM4ETDP1KMT2AMEN1
Hydrochloric Acid SCHEMBL1072411 0.64 MAPT (0.39) MAPTKDM4ETDP1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6919412-B1 Monocyclopentadienyl complexes of chromium, molybdenum or tungsten with a donor bridge BASELL POLYOLEFINE GMBH (DE) 2005-07-19 US disclosed