SCHEMBL29138915

SCHEMBL29138915

O=CN1CCNCC1c1ccc(C(F)(F)F)cc1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 9/20 0.43
HTR2B P41595 6/20 0.39
HTR2A P28223 5/20 0.39
HTR6 P50406 1/20 0.37
MAOB P27338 1/20 0.36

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
SCHEMBL29138924 1.00 HTR2C (0.43) HTR2CHTR2BHTR2AHTR6MAOB
SCHEMBL29138927 1.00 HTR2C (0.43) HTR2CHTR2BHTR2AHTR6MAOB
SCHEMBL2337017 0.85 DPP4 (0.40) HTR2CHTR2BHTR2AHTR6MAOB
SCHEMBL31581033 0.81 HTR3A (0.44) HTR2CHTR2BHTR2A
SCHEMBL16412550 0.81 KCNH2 (0.58) MAOB
SCHEMBL14831356 0.80 HTR2C (0.42) HTR2CHTR2BHTR2A
SCHEMBL5553500 0.80 HTR2C (0.42) HTR2CHTR2BHTR2A
Hydrochloric Acid SCHEMBL15173335 0.79 HTR2C (0.41) HTR2CHTR2BHTR2A
SCHEMBL7624365 0.78 HTR2C (0.46) HTR2CHTR2BHTR2AHTR6
SCHEMBL28148132 0.78 PDE2A (0.40) HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116888120-A PRMTS inhibitors 美国安进公司 2023-10-13 CN disclosed