SCHEMBL25282956

SCHEMBL25282956

CN1CCN(Cc2cccc(B(O)c3ccc(C#N)cc3)c2)CC1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MC4R P32245 1/20 0.44
HRH3 Q9Y5N1 2/20 0.44
FAAH O00519 2/20 0.42
CHKA P35790 3/20 0.41
CHRM3 P20309 2/20 0.41
AURKA O14965 1/20 0.40
AURKB Q96GD4 1/20 0.40
CCR2 P41597 1/20 0.40
KCNJ1 P48048 1/20 0.40
KCNH2 Q12809 1/20 0.40
HTR6 P50406 1/20 0.39
KDM1A O60341 1/20 0.39
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
RAB9A P51151 1/20 0.39
TNIK Q9UKE5 1/20 0.39

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
SCHEMBL29809149 0.79 HRH3 (0.60) MC4RHRH3FAAHCHKAKCNJ1
SCHEMBL1482500 0.79 HRH3 (0.60) MC4RHRH3FAAHCHKAKCNJ1
SCHEMBL3666137 0.79 MC4R (0.57) MC4RHRH3CHKANPC1TP53
Hydrochloric Acid SCHEMBL29953930 0.78 MC4R (0.56) MC4RHRH3CHKANPC1TP53
SCHEMBL25284229 0.76 CHKA (0.49) MC4RCHKAKCNJ1KCNH2
SCHEMBL148919 0.76 KCNJ1 (0.61) MC4RHRH3FAAHCHKACCR2
SCHEMBL12725366 0.75 DRD2 (0.55) MC4RHRH3FAAHCHKACHRM3
SCHEMBL2227678 0.75 HRH3 (0.62) MC4RHRH3FAAHCHKA
SCHEMBL2397894 0.74 ENPP2 (0.43)
SCHEMBL26646726 0.74 CHKA (0.41) HRH3CHKAAURKAAURKBKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230340530-A1 Methods of Protecting RNA PFIZER INC. (US) 2023-10-26 US claimed
EP-4204012-A1 METHODS OF PROTECTING RNA Pfizer Inc. (US) 2023-07-05 EP claimed
US-20230340530-A1 Methods of Protecting RNA PFIZER INC. (US) 2023-10-26 US disclosed
EP-4204012-A1 METHODS OF PROTECTING RNA Pfizer Inc. (US) 2023-07-05 EP disclosed