SCHEMBL29644497

SCHEMBL29644497

CN1CCC(=C(F)c2cccc(NC(=O)c3c(F)cc(F)cc3F)n2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR1F P30939 15/20 1.00
HTR1A P08908 1/20 1.00
HTR1B P28222 1/20 1.00
HTR2A P28223 1/20 1.00
HTR2C P28335 1/20 1.00
HTR2B P41595 1/20 1.00
CHRM5 P08912 1/20 0.67
DRD5 P21918 1/20 0.67
HTR1D P28221 1/20 0.67
HTR1E P28566 1/20 0.67
HTR7 P34969 1/20 0.67
OPRK1 P41145 1/20 0.67
TMEM97 Q5BJF2 1/20 0.67
SIGMAR1 Q99720 1/20 0.67
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
GRM5 P41594 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
SCHEMBL21770793 1.00 HTR1F (1.00) HTR1FHTR1AHTR1BHTR2AHTR2C
SCHEMBL21770761 0.89 HTR1F (1.00) HTR1FHTR1AHTR1BHTR2AHTR2C
SCHEMBL28807271 0.88 HTR1F (0.79) HTR1FHTR1AHTR1BHTR2AHTR2C
SCHEMBL21770996 0.87 HTR1F (1.00) HTR1FHTR1AHTR1BHTR2AHTR2C
SCHEMBL21770760 0.86 HTR1F (1.00) HTR1FHTR1AHTR1BHTR2AHTR2C
SCHEMBL21770757 0.85 HTR1F (0.80) HTR1FHTR1AHTR1BHTR2AHTR2C
SCHEMBL26972708 0.85 HTR1F (0.79) HTR1FHTR1AHTR1BHTR2AHTR2C
SCHEMBL21770756 0.85 HTR1F (0.79) HTR1FHTR1AHTR1BHTR2AHTR2C
SCHEMBL21770995 0.84 HTR1F (1.00) HTR1FHTR1AHTR1BHTR2AHTR2C
SCHEMBL29764265 0.84 HTR1F (1.00) HTR1FHTR1AHTR1BHTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4271671-A1 SALTS OF PYRIDINYLMETHYLENEPIPERIDINE DERIVATIVES AND USES THEREOF Sunshine Lake Pharma Co., Ltd. (CN) 2023-11-08 EP disclosed
CN-114685445-B Salts of pyridyleiperidine derivatives and uses thereof 广东东阳光药业有限公司 2023-07-18 CN disclosed
CN-114685443-B Salts of pyridyleiperidine derivatives and uses thereof 广东东阳光药业有限公司 2023-07-18 CN disclosed
CN-114685441-B Salts of pyridyleiperidine derivatives and uses thereof 广东东阳光药业有限公司 2023-07-18 CN disclosed
CN-114685444-B Salts of pyridyleiperidine derivatives and uses thereof 广东东阳光药业有限公司 2023-07-18 CN disclosed
CN-114685440-B Salts of pyridyleiperidine derivatives and uses thereof 广东东阳光药业有限公司 2023-07-18 CN disclosed
WO-2022143622-A1 SALTS OF PYRIDINYLMETHYLENEPIPERIDINE DERIVATIVES AND USES THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2022-07-07 WO disclosed
CN-114685443-A Salts of pyridinylalkenylpiperidine derivatives and use thereof 广东东阳光药业有限公司 2022-07-01 CN disclosed
CN-114685444-A Salts of pyridinylalkenylpiperidine derivatives and use thereof 广东东阳光药业有限公司 2022-07-01 CN disclosed
CN-114685442-A Salts of pyridinylalkenylpiperidine derivatives and use thereof 广东东阳光药业有限公司 2022-07-01 CN disclosed
CN-114685440-A Salts of pyridinylalkenylpiperidine derivatives and use thereof 广东东阳光药业有限公司 2022-07-01 CN disclosed