SCHEMBL22878533

SCHEMBL22878533

CCOC(C)C1CCN(c2ncc(C(F)(F)F)cn2)CC1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 2/20 0.44
▸ OGA O60502 6/20 0.43
▸ TIPARP Q7Z3E1 8/20 0.42
▸ CXCR3 P49682 1/20 0.39
▸ PARP1 P09874 1/20 0.38
▸ ACACB O00763 1/20 0.38
▸ PPARG P37231 1/20 0.38
▸ PPARD Q03181 1/20 0.38
▸ PPARA Q07869 1/20 0.38
▸ TNKS O95271 1/20 0.38
▸ PARP14 Q460N5 1/20 0.38
▸ PARP10 Q53GL7 1/20 0.38
▸ PARP12 Q9H0J9 1/20 0.38
▸ TNKS2 Q9H2K2 1/20 0.38
▸ PARP11 Q9NR21 1/20 0.38
▸ PARP2 Q9UGN5 1/20 0.38

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
SCHEMBL19457343 0.86 OGA (0.44) GPR119OGATIPARPCXCR3ACACB
SCHEMBL19450528 0.84 OGA (0.43) GPR119OGATIPARPCXCR3ACACB
SCHEMBL19435030 0.82 OGA (0.45) GPR119OGATIPARPPARP1ACACB
SCHEMBL19435009 0.82 OGA (0.45) GPR119OGATIPARPPARP1ACACB
SCHEMBL19434300 0.82 OGA (0.45) GPR119OGATIPARPPARP1ACACB
SCHEMBL26124908 0.79 SMN1; SMN2 (0.46) GPR119TIPARPACACBPPARGPPARD
SCHEMBL26121974 0.77 PPARG (0.44) GPR119OGATIPARPPARP1PPARG
SCHEMBL26126273 0.77 ACACB (0.45) OGATIPARPACACBPPARGPPARD
SCHEMBL26126441 0.77 ACACB (0.45) OGATIPARPPARP1ACACBPPARG
SCHEMBL28982910 0.76 LMNA (0.46) GPR119OGATIPARPPARP1ACACB

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-2021005436-A1 COMBINATION THERAPY OF GPR119 AGONISTS AND DPP-4 INHIBITORS MANKIND PHARMA LTD. (IN) 2021-01-14 — — WO disclosed
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