SCHEMBL24320574

SCHEMBL24320574

Fc1cc(Cl)ccc1COc1nc(N2CCCCCC2)ncc1F

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 6/20 0.47
▸ MAPK14 Q16539 1/20 0.40
▸ KCNH2 Q12809 2/20 0.39
▸ SIGMAR1 Q99720 1/20 0.38
▸ INPPL1 O15357 1/20 0.38
▸ CNR1 P21554 1/20 0.38
▸ CYP1A2 P05177 2/20 0.38
▸ CYP2C9 P11712 2/20 0.38
▸ TBXA2R P21731 2/20 0.38
▸ PTGS1 P23219 2/20 0.38
▸ CYP2C19 P33261 2/20 0.38
▸ PTGER1 P34995 2/20 0.38
▸ PTGER3 P43115 2/20 0.38
▸ PTGER2 P43116 2/20 0.38
▸ HTR3A P46098 1/20 0.38
▸ CCR4 P51679 1/20 0.37
▸ CXCR3 P49682 1/20 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
SCHEMBL24147695 0.89 INPPL1 (0.50) GLP1RMAPK14SIGMAR1INPPL1CYP1A2
SCHEMBL26914337 0.81 GLP1R (0.44) GLP1RMAPK14KCNH2INPPL1
SCHEMBL26914340 0.81 GLP1R (0.44) GLP1RMAPK14KCNH2INPPL1
Trifluoroacetic Acid SCHEMBL30662706 0.81 GLP1R (0.48) GLP1RINPPL1CYP1A2CYP2C9TBXA2R
Hydrochloric Acid SCHEMBL26914560 0.80 GLP1R (0.44) GLP1RMAPK14KCNH2INPPL1
Hydrochloric Acid SCHEMBL30662717 0.80 GLP1R (0.44) GLP1RMAPK14KCNH2INPPL1
SCHEMBL26913667 0.80 GPR119 (0.57) GLP1RCCR4
SCHEMBL23235663 0.80 GLP1R (0.61) GLP1RCCR4
SCHEMBL23235709 0.79 MAPK14 (0.44) MAPK14KCNH2CNR1CYP1A2CYP2C9
SCHEMBL26914109 0.77 GLP1R (0.48) GLP1RCCR4CXCR3

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
WO-2022078407-A1 HETEROCYCLIC GLP-1 AGONISTS GASHERBRUM BIO, INC. (US) 2022-04-21 — — WO disclosed
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