SCHEMBL30523620

SCHEMBL30523620

CC(C)COc1ccc(CNC(=O)N(Cc2ccc(Cl)cc2Cl)C2CCNCC2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 18/20 0.69
▸ SLC6A2 P23975 3/20 0.54
▸ KCNH2 Q12809 2/20 0.54
▸ ABCB11 O95342 1/20 0.54
▸ CYP1A2 P05177 1/20 0.54
▸ ADRB2 P07550 1/20 0.54
▸ CHRM2 P08172 1/20 0.54
▸ CHRM1 P11229 1/20 0.54
▸ DRD1 P21728 1/20 0.54
▸ TBXA2R P21731 1/20 0.54
▸ HTR2C P28335 1/20 0.54
▸ GPR183 P32249 1/20 0.54
▸ CYP2C19 P33261 1/20 0.54
▸ ADRA1A P35348 1/20 0.54
▸ OPRM1 P35372 1/20 0.54
▸ APLNR P35414 1/20 0.54
▸ DRD3 P35462 1/20 0.54
▸ CX3CR1 P49238 1/20 0.54
▸ SLC6A3 Q01959 1/20 0.54
▸ GPR65 Q8IYL9 1/20 0.54

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
SCHEMBL20766355 1.00 HTR2A (0.69) HTR2ASLC6A2KCNH2ABCB11CYP1A2
SCHEMBL20778635 0.92 HTR2A (0.78) HTR2ASLC6A2KCNH2ABCB11CYP1A2
SCHEMBL20766393 0.92 HTR2A (0.72) HTR2ASLC6A2KCNH2ABCB11CYP1A2
SCHEMBL20766516 0.90 HTR2A (0.59) HTR2ASLC6A2KCNH2SLC6A3SLC6A4
SCHEMBL20766291 0.89 HTR2A (0.77) HTR2ASLC6A2KCNH2ABCB11CYP1A2
SCHEMBL30523690 0.89 HTR2A (0.77) HTR2ASLC6A2KCNH2ABCB11CYP1A2
SCHEMBL25570178 0.86 HTR2A (0.77) HTR2ASLC6A2KCNH2ABCB11CYP1A2
SCHEMBL20766269 0.84 HTR2A (0.80) HTR2ASLC6A2KCNH2ABCB11CYP1A2
SCHEMBL20778649 0.84 HTR2A (0.69) HTR2ASLC6A2KCNH2ABCB11CYP1A2
SCHEMBL20778677 0.82 HTR2A (0.54) HTR2ASLC6A2KCNH2ABCB11CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4635568-A2 COMPOUNDS, SALTS THEREOF AND METHODS FOR TREATMENT OF DISEASES ACADIA Pharmaceuticals Inc. (US) 2025-10-22 — — EP claimed
EP-4635568-A2 COMPOUNDS, SALTS THEREOF AND METHODS FOR TREATMENT OF DISEASES ACADIA Pharmaceuticals Inc. (US) 2025-10-22 — — EP disclosed
CN-117466803-A Compounds, salts thereof and methods for treating diseases 阿卡蒂亚药品公司 2024-01-30 — — CN disclosed
CN-111132976-B Compounds, salts thereof and methods for treating diseases 阿卡蒂亚药品公司 2023-08-22 — — CN disclosed
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