SCHEMBL7783130

SCHEMBL7783130

CC1=Cc2c(-c3cccc4ccccc34)cccc2C1[Si](C)(C)C1C(C)=Cc2c(-c3cccc4ccccc34)cccc21.C[Si](C)(C1C=Cc2c(-c3cccc4ccccc34)cccc21)C1C=Cc2c(-c3cccc4ccccc34)cccc21

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ENPP3 O14638 1/20 0.32
ENPP1 P22413 1/20 0.32
NPC1 O15118 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
ALOX15 P16050 1/20 0.30
DHFR P00374 1/20 0.30
MAOA P21397 1/20 0.30
MAOB P27338 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
SCHEMBL3149399 0.89 ENPP3 (0.38) ENPP3ENPP1NPC1MAPTRAB9A
SCHEMBL7036431 0.88 MAPT (0.37) ENPP3ENPP1NPC1MAPTRAB9A
Hydrochloric Acid SCHEMBL5167145 0.86 ENPP3 (0.36) ENPP3ENPP1NPC1MAPTRAB9A
SCHEMBL1452672 0.82 ENPP3 (0.33) ENPP3ENPP1NPC1MAPTRAB9A
SCHEMBL7054875 0.81 ENPP3 (0.38) ENPP3ENPP1NPC1MAPTRAB9A
SCHEMBL7783128 0.79 ENPP3 (0.32) ENPP3ENPP1NPC1MAPTRAB9A
SCHEMBL7053238 0.79 ENPP3 (0.36) ENPP3ENPP1NPC1MAPTRAB9A
SCHEMBL4466994 0.79 ENPP3 (0.36) ENPP3ENPP1NPC1MAPTRAB9A
SCHEMBL3144749 0.78 ALDH1A1 (0.37) ENPP3ENPP1MAPTMAOAMAOB
SCHEMBL14448393 0.77 CA12 (0.32) ENPP3ENPP1MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1133504-A1 METHOD FOR PRODUCING MONOARYLOXY-ANSA-METALLOCENES Basell Polypropylen GmbH (DE) 2001-09-19 EP disclosed
WO-2000031091-A1 METHOD FOR PRODUCING MONOARYLOXY-ANSA-METALLOCENES BASELL POLYPROPYLEN GMBH (DE) 2000-06-02 WO disclosed