SCHEMBL6907027

SCHEMBL6907027

CCCCCCCCC1=C(C)C=CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.39
BACE1 P56817 1/20 0.39
SCD O00767 1/20 0.39
DNM1 Q05193 1/20 0.38
MGLL Q99685 3/20 0.35
FAAH O00519 2/20 0.35
PTGS2 P35354 6/20 0.34
PTGS1 P23219 4/20 0.34
ESR1 P03372 2/20 0.34
ADRA2A P08913 2/20 0.34
ADORA3 P0DMS8 2/20 0.34
TACR2 P21452 2/20 0.34
SLC6A2 P23975 2/20 0.34
SLC6A4 P31645 2/20 0.34
SLC6A3 Q01959 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
SHBG P04278 1/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL6910834 1.00 ACHE (0.39) ACHEBACE1SCDDNM1MGLL
SCHEMBL6053814 0.92 NPC1 (0.32) KDM4E
SCHEMBL4810881 0.92 NPC1 (0.32) KDM4E
SCHEMBL27460814 0.90 NPC1 (0.31) KDM4E
SCHEMBL6286176 0.83
SCHEMBL4809308 0.83
SCHEMBL5345920 0.80 SCD (0.39) ACHEBACE1SCDMGLLFAAH
SCHEMBL8951736 0.80 SCD (0.39) ACHEBACE1SCDMGLLFAAH
SCHEMBL27536271 0.79 ACHE (0.44) ACHEBACE1MGLLFAAHPTGS2
SCHEMBL6911326 0.78 SCD (0.38) ACHEBACE1SCDMGLLFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1189435-C Novel transition metal compound and catalyst containing the same for polymerization of olefins JAPAN POLYOLEFINS CO LTD (JP) 2005-02-16 CN disclosed
EP-0969010-B1 Transition metal compound and catalyst containing the same for polymerization of olefins JAPAN POLYOLEFINS CO LTD (JP) 2004-09-22 EP disclosed
US-6352953-B1 TRANSITION METAL COMPLEX HAVING 5-MEMBERED RING FORMED BY TRANSITION METAL COMPOUND OF GROUP IVB, TWO CARBONS, METAL OF GROUP IIIA AND HYDROGEN JAPAN POLYOLEFINS CO., LTD. (JP) 2002-03-05 US disclosed
US-6150544-A Transition metal compound and catalyst containing the same for polymerization of olefins JAPAN POLYOLEFINS CO., LTD. (JP) 2000-11-21 US disclosed
CN-1240782-A Novel transition metal compound and catalyst containing the same for polymerization of olefins JAPAN POLYOLEFINS CO LTD (JP) 2000-01-12 CN disclosed
EP-0969010-A2 Transition metal compound and catalyst containing the same for polymerization of olefins Japan Polyolefins Co., Ltd. (JP) 2000-01-05 EP disclosed