SCHEMBL30350708

SCHEMBL30350708

CCCOc1cccc(I)c1OCCC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 2/20 0.49
▸ LMNA P02545 1/20 0.49
▸ CHRM1 P11229 1/20 0.49
▸ ALOX15 P16050 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ ACHE P22303 1/20 0.49
▸ KCNH2 Q12809 1/20 0.49
▸ HIF1A Q16665 1/20 0.49
▸ MCHR1 Q99705 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ CYP2A6 P11509 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ HTR1A P08908 1/20 0.38
▸ ADRA1D P25100 1/20 0.38
▸ ADRA1A P35348 1/20 0.38
▸ ADRA1B P35368 1/20 0.38
▸ GAA P10253 2/20 0.37

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
SCHEMBL19510572 1.00 CHRM2 (0.49) CHRM2LMNACHRM1ALOX15TSHR
SCHEMBL1114869 0.89 CHRM2 (0.46) CHRM2LMNACHRM1ALOX15TSHR
SCHEMBL2197109 0.87 MCHR1 (0.47) CHRM2LMNACHRM1ALOX15TSHR
SCHEMBL8557526 0.86 LMNA (0.62) CHRM2LMNACHRM1ALOX15TSHR
SCHEMBL7595261 0.85 HTR1A (0.53) L3MBTL1HTR1AADRA1DADRA1AADRA1B
SCHEMBL9968957 0.82 CYP1A2 (0.47) LMNAKCNH2HIF1AMCHR1CYP2A6
SCHEMBL18525261 0.81 ALDH1A1 (0.41) CHRM2LMNACHRM1ALOX15TSHR
SCHEMBL2821419 0.81 KCNH2 (0.41) CHRM2LMNACHRM1ALOX15TSHR
SCHEMBL28625619 0.80 ALDH1A1 (0.45) CHRM2LMNACHRM1ALOX15TSHR
SCHEMBL15634619 0.79 MCHR1 (0.41) CHRM2LMNACHRM1ALOX15TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107567443-B Biaryl derivatives as GPR120 agonists 株式会社LG化学 2023-04-28 — — CN disclosed
CN-115925679-A Biaryl derivatives as GPR120 agonists 株式会社LG化学 2023-04-07 — — CN disclosed
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