SCHEMBL7733562

SCHEMBL7733562

Cl[Zr](Cl)(C1=Cc2ccccc2C1c1ccccn1)C1=Cc2ccccc2C1c1ccccn1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
MAPT P10636 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 3/20 0.35
HSD17B10 Q99714 2/20 0.35
CASP1 P29466 2/20 0.34
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
POLB P06746 1/20 0.31
CCR1 P32246 1/20 0.31
CCR5 P51681 1/20 0.31
CCR8 P51685 1/20 0.31
METAP1 P53582 1/20 0.31
BLM P54132 1/20 0.31
HIF1A Q16665 1/20 0.31
DOHH Q9BU89 1/20 0.31
P4HTM Q9NXG6 1/20 0.31

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
SCHEMBL28460906 0.79 ALDH1A1 (0.43) ALDH1A1MAPTNPC1RAB9AKMT2A
SCHEMBL27992832 0.76 ALDH1A1 (0.43) ALDH1A1MAPTNPC1RAB9AKMT2A
SCHEMBL6904701 0.76 ALDH1A1 (0.43) ALDH1A1MAPTNPC1RAB9AKMT2A
SCHEMBL6900112 0.74 ALDH1A1 (0.42) ALDH1A1MAPTNPC1RAB9AKMT2A
Hydrochloric Acid SCHEMBL6895486 0.74 ALDH1A1 (0.42) ALDH1A1MAPTNPC1RAB9AKMT2A
SCHEMBL6902972 0.67 SLC6A2 (0.37) ALDH1A1MAPTKMT2AKDM4EHSD17B10
SCHEMBL483646 0.66 ALDH1A1 (0.62) ALDH1A1MAPTNPC1RAB9AKMT2A
SCHEMBL7064228 0.66 KDM4E (0.39) ALDH1A1MAPTNPC1RAB9AKDM4E
Hydrochloric Acid SCHEMBL11680674 0.65 ALDH1A1 (0.60) ALDH1A1MAPTNPC1RAB9AKMT2A
SCHEMBL3320836 0.61 ALDH1A1 (0.38) ALDH1A1MAPTNPC1RAB9AKMT2A

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-6458982-B1 CATALYST SYSTEM COMPRISING AT LEAST ONE METALLOCENE AND AT LEAST ONE COCATALYST. ON SUPPORT. TARGOR GMBH (DE) 2002-10-01 US disclosed