SCHEMBL21770995

SCHEMBL21770995

CN1CCC(=C(F)c2cccc(NC(=O)c3ccc(F)cc3)n2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR1F P30939 18/20 1.00
HTR1A P08908 2/20 0.73
HTR1B P28222 2/20 0.73
HTR2A P28223 2/20 0.73
HTR2C P28335 2/20 0.73
HTR2B P41595 1/20 0.73
HTR1D P28221 2/20 0.49
HTR1E P28566 2/20 0.49
HTR4 Q13639 1/20 0.49
CHRM5 P08912 1/20 0.47
DRD5 P21918 1/20 0.47
HTR7 P34969 1/20 0.47
OPRK1 P41145 1/20 0.47
TMEM97 Q5BJF2 1/20 0.47
SIGMAR1 Q99720 1/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
CYP2D6 P10635 1/20 0.45

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
SCHEMBL29764265 1.00 HTR1F (1.00) HTR1FHTR1AHTR1BHTR2AHTR2C
SCHEMBL29764248 0.91 HTR1F (1.00) HTR1FHTR1AHTR1BHTR2AHTR2C
SCHEMBL21771024 0.91 HTR1F (1.00) HTR1FHTR1AHTR1BHTR2AHTR2C
SCHEMBL28807272 0.88 HTR1F (0.78) HTR1FHTR1AHTR1BHTR2AHTR2C
SCHEMBL21771025 0.87 HTR1F (1.00) HTR1FHTR1AHTR1BHTR2AHTR2C
SCHEMBL29764278 0.87 HTR1F (1.00) HTR1FHTR1AHTR1BHTR2AHTR2C
SCHEMBL21770996 0.85 HTR1F (1.00) HTR1FHTR1AHTR1BHTR2AHTR2C
SCHEMBL29644497 0.84 HTR1F (1.00) HTR1FHTR1AHTR1BHTR2AHTR2C
SCHEMBL21770793 0.84 HTR1F (1.00) HTR1FHTR1AHTR1BHTR2AHTR2C
SCHEMBL23528939 0.84 HTR1F (0.72) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11858910-B2 Pyridinylmethylenepiperidine derivatives and uses thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2024-01-02 US disclosed
US-11858910-B2 Pyridinylmethylenepiperidine derivatives and uses thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2024-01-02 US disclosed
US-11858910-B2 Pyridinylmethylenepiperidine derivatives and uses thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2024-01-02 US disclosed
CN-110437205-B Pyridinonylpiperidine derivatives and use thereof 广东东阳光药业有限公司 2022-07-08 CN disclosed
US-20210188803-A1 PYRIDINYLMETHYLENEPIPERIDINE DERIVATIVES AND USES THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2021-06-24 US disclosed
US-20210188803-A1 PYRIDINYLMETHYLENEPIPERIDINE DERIVATIVES AND USES THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2021-06-24 US disclosed
WO-2020038435-A1 PYRIDINYLMETHYLENEPIPERIDINE DERIVATIVES AND USES THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2020-02-27 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11858910-B2 Pyridinylmethylenepiperidine derivatives and uses thereof HTR1F, HTR1A, HTR5A HTR1F 1/4885HTR1A 2/4885HTR1B 6/4885
US-20210188803-A1 PYRIDINYLMETHYLENEPIPERIDINE DERIVATIVES AND USES THEREOF HTR1F, HTR1A, HTR5A HTR1F 1/4885HTR1A 2/4885HTR1B 6/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.