SCHEMBL3211330

SCHEMBL3211330

N=C(c1cc2ccccc2cc1C1c2ccccc2-c2ccccc21)C1CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.37
RAB9A P51151 3/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
BCHE P06276 1/20 0.36
ACHE P22303 1/20 0.36
MAPT P10636 1/20 0.35
ALDH1A1 P00352 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
IDO1 P14902 2/20 0.32
KDM4E B2RXH2 2/20 0.32
CYP2C19 P33261 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
SCHEMBL3199116 0.84 BCHE (0.40) MEN1KMT2ABCHEACHEALDH1A1
SCHEMBL3198701 0.80 NPC1 (0.36) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL3213680 0.78 KDM4E (0.36) NPC1RAB9ABCHEACHEALDH1A1
SCHEMBL3198186 0.78 RAB9A (0.34) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL3202297 0.78 CNR1 (0.38) RAB9AMEN1KMT2ABCHEACHE
SCHEMBL3204117 0.76 NPC1 (0.33) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL3191412 0.74 CYP2D6 (0.35) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL3208398 0.72 SMN1; SMN2 (0.32) MEN1KMT2AMAPTALDH1A1IDO1
SCHEMBL3677255 0.71 PNMT (0.35) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL3202908 0.69 NPC1 (0.33) NPC1RAB9AMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7671226-B2 Transition metal complex, catalyst for olefin polymerization, and process for producing olefin polymer with the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-02 US disclosed
EP-1426379-B1 TRANSITION METAL COMPLEX,CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PRODUCING OLEFIN POLYMER WITH THE SAME SUMITOMO CHEMICAL CO (JP) 2009-11-11 EP disclosed
US-7439379-B2 Transition metal complex, catalyst for olefin polymerization, and process for producing olefin polymer with the same SUMITOMO CHEMICAL CO., LTD. (JP) 2008-10-21 US disclosed