SCHEMBL31358686

SCHEMBL31358686

FCc1cccc2c1C(Cl)c1ccccc1-2

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.34
SLC22A2 O15244 1/20 0.32
SLC22A3 O75751 1/20 0.32
PPIA P62937 2/20 0.31
GPR3 P46089 1/20 0.31
PDCD1 Q15116 1/20 0.30
CD274 Q9NZQ7 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
SCHEMBL28430401 0.74 ALDH1A1 (0.44) PPIA
SCHEMBL5618043 0.73 CACNB4 (0.39) HTR2APPIAGPR3
SCHEMBL27499426 0.72 ALDH1A1 (0.39) HTR2ASLC22A2SLC22A3GPR3
SCHEMBL6018181 0.72 MAPK1 (0.35) HTR2ASLC22A2SLC22A3GPR3
SCHEMBL5343918 0.71 GPR3 (0.46) HTR2ASLC22A2SLC22A3GPR3
SCHEMBL31266545 0.71 GPR3 (0.46) HTR2ASLC22A2SLC22A3GPR3
Hydrochloric Acid SCHEMBL29281106 0.69 GPR3 (0.44) HTR2ASLC22A2SLC22A3GPR3
SCHEMBL6449582 0.68 GPR3 (0.34) HTR2ASLC22A2SLC22A3GPR3
SCHEMBL1538622 0.66 KCNN4 (0.43) GPR3PDCD1CD274
SCHEMBL28167253 0.64 PDCD1 (0.44) HTR2APDCD1CD274

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-119246734-A Method for measuring taurine content in functional beverage by HPLC 泉州圣元生物科学研究院有限公司 2025-01-03 CN claimed