SCHEMBL22081099

SCHEMBL22081099

NC(=O)C(O)c1ccc(N)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.39
TSHR P16473 3/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPK1 P28482 1/20 0.39
NT5E P21589 1/20 0.39
MAPT P10636 3/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
RAB9A P51151 2/20 0.38
POLB P06746 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PARP10 Q53GL7 1/20 0.38
GRM8 O00222 1/20 0.38
GRM7 Q14831 1/20 0.38
GRM4 Q14833 1/20 0.38
CYP3A4 P08684 2/20 0.37
MPO P05164 1/20 0.37
CYP2C9 P11712 1/20 0.37
HTR6 P50406 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
SCHEMBL22082536 1.00 LMNA (0.39) LMNATSHRALDH1A1MAPK1NT5E
SCHEMBL22082538 1.00 LMNA (0.39) LMNATSHRALDH1A1MAPK1NT5E
SCHEMBL15579331 0.85 MAOB (0.48) LMNACNR2
SCHEMBL1094783 0.81 LMNA (0.62) LMNATSHRALDH1A1MAPK1NT5E
SCHEMBL4877111 0.81 HIF1A (0.48) LMNATSHRALDH1A1MAPK1MAPT
SCHEMBL1094781 0.81 LMNA (0.62) LMNATSHRALDH1A1MAPK1NT5E
SCHEMBL1093539 0.81 LMNA (0.62) LMNATSHRALDH1A1MAPK1NT5E
SCHEMBL24355251 0.79 TSHR (0.42) LMNATSHRALDH1A1MAPK1NT5E
SCHEMBL5068688 0.79 BRD4 (0.45) LMNATSHRALDH1A1MAPTMEN1
SCHEMBL24355244 0.79 TSHR (0.42) LMNATSHRALDH1A1MAPK1NT5E

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-2020115190-A1 NOVEL ANTIBACTERIAL 3\"-DERIVATIVES OF 4,6-DISUBSTITUTED 2,5-DIDEOXYSTREPTAMINE AMINOGLYCOSIDE ANTIBIOTICS AGILEBIOTICS B.V. (NL) 2020-06-11 WO disclosed