SCHEMBL6909896

SCHEMBL6909896

Cc1ccc([B-](c2ccc(C)cc2)(c2ccc(C)cc2)c2ccc(C)cc2)cc1.c1ccc([PH+](c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.42
ACHE P22303 2/20 0.42
TSHR P16473 1/20 0.42
ALOX12 P18054 1/20 0.42
HPGD P15428 3/20 0.37
NPC1 O15118 4/20 0.35
RAB9A P51151 4/20 0.35
TDP1 Q9NUW8 3/20 0.35
NFKB1 P19838 2/20 0.35
NFKB2 Q00653 2/20 0.35
RELA Q04206 2/20 0.35
POLB P06746 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
MEN1 O00255 5/20 0.32
KMT2A Q03164 5/20 0.32
ALDH1A1 P00352 3/20 0.32
MAPT P10636 2/20 0.32
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL5909841 0.84 ACHE (0.53) LMNAACHETSHRALOX12HPGD
SCHEMBL335967 0.84 ALDH1A1 (0.35) ALDH1A1
SCHEMBL7034016 0.84 ACHE (0.53) LMNAACHETSHRALOX12HPGD
SCHEMBL21810702 0.81 ACHE (0.50) LMNAACHETSHRALOX12HPGD
SCHEMBL21810715 0.81 ACHE (0.50) LMNAACHETSHRALOX12HPGD
Biphenyl SCHEMBL4385685 0.79 ALDH1A1 (0.45) LMNAALOX12HPGDNPC1RAB9A
Tetraphenylphosphonium SCHEMBL503790 0.78 TSHR (0.42) LMNAACHETSHRALOX12HPGD
SCHEMBL6911056 0.78 NFE2L2 (0.37) NPC1MAPTL3MBTL1HTTNPSR1
SCHEMBL473142 0.78 ACHE (0.57) LMNAACHETSHRALOX12TDP1
SCHEMBL6913511 0.78 ACHE (0.41) LMNAACHETSHRALOX12HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109790357-B Curable modified petroleum resin, preparation method and application thereof 可隆工业株式会社 2022-04-12 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
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
EP-0714920-B1 Catalyst for polymerization of olefins NIPPON OIL CO LTD (JP) 1997-11-05 EP disclosed
EP-0768320-A1 Catalyst component and catalyst NIPPON OIL CO. LTD. (JP) 1997-04-16 EP disclosed
EP-0714920-A1 Catalyst for polymerization of olefins NIPPON OIL CO. LTD. (JP) 1996-06-05 EP disclosed