SCHEMBL19682897

SCHEMBL19682897

NCCc1ccc(NC(=O)OCc2ccccc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.62
TP53 P04637 2/20 0.61
MAPT P10636 2/20 0.61
KDM1A O60341 3/20 0.60
MAOA P21397 2/20 0.60
MAOB P27338 2/20 0.60
RCOR1 Q9UKL0 2/20 0.59
NPC1 O15118 3/20 0.56
RAB9A P51151 3/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
RECQL P46063 1/20 0.56
MGLL Q99685 1/20 0.56
ROCK2 O75116 1/20 0.55
ALDH1A1 P00352 1/20 0.53
TSHR P16473 1/20 0.53
ATM Q13315 1/20 0.53
ENPP2 Q13822 1/20 0.51

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
SCHEMBL3942525 0.88 POLB (0.66) POLBTP53MAPTKDM1AMAOA
Hydrochloric Acid SCHEMBL3942522 0.87 POLB (0.64) POLBTP53MAPTKDM1AMAOA
SCHEMBL8867533 0.87 POLB (0.64) POLBTP53MAPTKDM1AMAOA
SCHEMBL3968088 0.87 POLB (0.64) POLBTP53MAPTKDM1AMAOA
SCHEMBL1707562 0.86 POLB (0.68) POLBTP53MAPTKDM1AMAOA
SCHEMBL21054940 0.85 POLB (0.62) POLBTP53MAPTKDM1AMAOA
SCHEMBL590420 0.85 POLB (0.62) POLBTP53MAPTKDM1AMAOA
SCHEMBL10598558 0.84 POLB (0.69) POLBTP53MAPTKDM1AMAOA
Benzyl Phenylcarbamate SCHEMBL1222943 0.84 POLB (0.78) POLBTP53MAPTKDM1AMAOA
SCHEMBL10595799 0.84 POLB (0.73) POLBTP53MAPTKDM1AMAOA

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
US-10954316-B2 Method for cleaving amide bonds Galderma Holding SA (CH) 2021-03-23 US disclosed
WO-2017207564-A1 METHOD FOR CLEAVING AMIDE BONDS GALDERMA S.A. (CH) 2017-12-07 WO disclosed