SCHEMBL30355145

SCHEMBL30355145

Cc1cccc(C)c1N.[Fe+2]

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD44 P16070 1/20 0.68
CYP3A4 P08684 3/20 0.48
TDP1 Q9NUW8 3/20 0.48
CYP2A6 P11509 2/20 0.47
CYP1A2 P05177 1/20 0.47
TSHR P16473 3/20 0.47
ACHE P22303 2/20 0.47
POLB P06746 1/20 0.46
ALDH1A1 P00352 5/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
PIK3CA P42336 1/20 0.45
TP53 P04637 1/20 0.45
NOS3 P29474 2/20 0.42
NOS2 P35228 2/20 0.42
NOS1 P29475 1/20 0.42
LMNA P02545 2/20 0.41
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL16776729 0.97 CD44 (0.72) CD44CYP3A4TDP1CYP2A6CYP1A2
SCHEMBL106244 0.97
Ammonia Solution, Strong SCHEMBL1289383 0.93 CD44 (0.68) CD44CYP3A4TDP1CYP2A6CYP1A2
Bromide SCHEMBL28370305 0.93 CD44 (0.68) CD44CYP3A4TDP1CYP2A6CYP1A2
Hydrochloric Acid SCHEMBL2864828 0.93 CD44 (0.68) CD44CYP3A4TDP1CYP2A6CYP1A2
Bromide SCHEMBL10391086 0.93 CD44 (0.68) CD44CYP3A4TDP1CYP2A6CYP1A2
SCHEMBL6687694 0.93 CD44 (0.68) CD44CYP3A4TDP1CYP2A6CYP1A2
Lithium SCHEMBL30421931 0.93 CD44 (0.68) CD44CYP3A4TDP1CYP2A6CYP1A2
Bromide SCHEMBL28506748 0.93 CD44 (0.68) CD44CYP3A4TDP1CYP2A6CYP1A2
SCHEMBL30303177 0.88 CD44 (0.62) CD44CYP3A4TDP1CYP2A6CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116037205-A Catalyst system for ethylene oligomerization and preparation method and application thereof 中国石油化工股份有限公司 2023-05-02 CN claimed
CN-116037205-B Catalyst system for ethylene oligomerization and preparation method and application thereof 中国石油化工股份有限公司 2025-07-04 CN disclosed
CN-117285404-A Oligomerization method of ethylene or propylene 中国石油化工股份有限公司 2023-12-26 CN disclosed
CN-117285559-A Cocatalyst for oligomerization of ethylene or propylene and catalyst composition containing the cocatalyst 中国石油化工股份有限公司 2023-12-26 CN disclosed
CN-117282467-A Catalyst composition for ethylene oligomerization 中国石油化工股份有限公司 2023-12-26 CN disclosed
CN-117282468-A Catalyst system for ethylene oligomerization reaction and preparation method and application thereof 中国石油化工股份有限公司 2023-12-26 CN disclosed
CN-116037206-A C (C) 2 -C 3 Catalyst component for olefin oligomerization, preparation method and application thereof 中国石油化工股份有限公司 2023-05-02 CN disclosed
CN-116037205-A Catalyst system for ethylene oligomerization and preparation method and application thereof 中国石油化工股份有限公司 2023-05-02 CN disclosed
CN-116037205-A Catalyst system for ethylene oligomerization and preparation method and application thereof 中国石油化工股份有限公司 2023-05-02 CN disclosed