SCHEMBL7633935

SCHEMBL7633935

C(C=Cc1ccccc1)=Cc1ccccc1.C1=C(N2CCCC2)c2ccccc2C1[Zr]C1C=C(N2CCCC2)c2ccccc21.O=CN[InH]NC=O

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.32
MAPT P10636 2/20 0.32
RAB9A P51151 2/20 0.32
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
SENP8 Q96LD8 1/20 0.30
SENP7 Q9BQF6 1/20 0.30
SENP6 Q9GZR1 1/20 0.30

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
SCHEMBL7943304 0.91 APAF1 (0.33) MAPT
SCHEMBL7636107 0.90 NPC1 (0.32) NPC1MAPTRAB9AKMT2AMEN1
SCHEMBL7638394 0.82 KMT2A (0.32) NPC1MAPTRAB9AKMT2AMEN1
SCHEMBL7935716 0.80 APAF1 (0.33) MAPT
SCHEMBL7638544 0.79 KMT2A (0.32) NPC1MAPTRAB9AKMT2AMEN1
Hydrochloric Acid SCHEMBL7633238 0.75 APAF1 (0.37) MAPT
Hydrochloric Acid SCHEMBL7632839 0.74 APAF1 (0.33) MAPT
SCHEMBL7943317 0.71 TSHR (0.33) MAPT
SCHEMBL7946696 0.67 TSHR (0.33) MAPT
SCHEMBL7636111 0.66 KMT2A (0.31) NPC1MAPTRAB9AKMT2AMEN1

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-20020098973-A1 Bridged gallium or indium containing group 4 metal complexes CAMPBELL RICHARD E (US) 2002-07-25 US disclosed