SCHEMBL28660742

SCHEMBL28660742

[Li]C1=Cc2cc(C)ccc2C1C

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.32
HTR2C P28335 2/20 0.32
CHRNB2 P17787 1/20 0.32
CHRNA4 P43681 1/20 0.32
CYP1A2 P05177 2/20 0.31
CYP2A6 P11509 2/20 0.31
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 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
SCHEMBL28676390 0.84 HTR2C (0.32) HTR2CCHRNB2CHRNA4CYP1A2CYP2A6
SCHEMBL29049889 0.79 SLC6A2 (0.35) ACHEHTR2CCHRNB2CHRNA4CYP1A2
SCHEMBL28947798 0.77 HTR2C (0.30) ACHEHTR2CCHRNB2CHRNA4
SCHEMBL28666657 0.76 SLC6A2 (0.33) ACHEHTR2CCHRNB2CHRNA4CYP1A2
SCHEMBL28675745 0.76
Hydrochloric Acid SCHEMBL28662630 0.74 SLC6A2 (0.33) ACHEHTR2CCHRNB2CHRNA4CYP1A2
SCHEMBL29842098 0.72 BRD4 (0.43)
SCHEMBL7827111 0.72 BRD4 (0.43)
SCHEMBL28666921 0.68
SCHEMBL5604678 0.67 HTR2C (0.31) ACHEHTR2CCHRNB2CHRNA4CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113748140-B Metal-ligand complexes 陶氏环球技术有限责任公司 2025-03-11 CN disclosed
CN-117050220-A Bimodal poly (ethylene-co-1-olefin) copolymers 陶氏环球技术有限责任公司 2023-11-14 CN disclosed
EP-4098670-A1 BIMODAL POLY(ETHYLENE-CO-1-ALKENE) COPOLYMER Dow Global Technologies LLC (US) 2022-12-07 EP disclosed
EP-3962970-A1 METAL-LIGAND COMPLEXES Dow Global Technologies LLC (US) 2022-03-09 EP disclosed
CN-113748140-A Metal-ligand complexes 陶氏环球技术有限责任公司 2021-12-03 CN disclosed
CN-113728020-A Bimodal poly (ethylene-co-1-olefin) copolymers 陶氏环球技术有限责任公司 2021-11-30 CN disclosed
CN-113677716-A Bimodal poly (ethylene-co-1-olefin) copolymers 陶氏环球技术有限责任公司 2021-11-19 CN disclosed