SCHEMBL19216397

SCHEMBL19216397

BC(=O)NCCc1ccc(O)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.67
F13A1 P00488 1/20 0.67
GAA P10253 2/20 0.56
NPC1 O15118 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP2D6 P10635 1/20 0.56
MAPT P10636 1/20 0.56
CYP2C19 P33261 1/20 0.56
RAB9A P51151 1/20 0.56
GFER P55789 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
TMEM97 Q5BJF2 1/20 0.53
SIGMAR1 Q99720 1/20 0.53
ESRRG P62508 4/20 0.53
ESRRB O95718 3/20 0.53
PLAAT3 P53816 1/20 0.51
PLAAT5 Q96KN8 1/20 0.51
PLAAT2 Q9NWW9 1/20 0.51
PLAAT4 Q9UL19 1/20 0.51
ABCG2 Q9UNQ0 1/20 0.50

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
SCHEMBL1437502 0.82 KDM4E (0.69) KDM4EF13A1GAANPC1CYP1A2
SCHEMBL14370357 0.82 KDM4E (0.69) KDM4EF13A1GAANPC1CYP1A2
SCHEMBL734658 0.80 KDM4E (1.00) KDM4EF13A1GAANPC1CYP1A2
SCHEMBL20144285 0.80 KDM4E (0.67) KDM4EF13A1GAANPC1CYP1A2
SCHEMBL19216398 0.80 KDM4E (0.67) KDM4EF13A1GAANPC1CYP1A2
SCHEMBL31420450 0.78 NPC1 (0.84) KDM4EF13A1GAANPC1CYP1A2
SCHEMBL4161209 0.78 ESRRB (0.77) KDM4EF13A1GAANPC1CYP1A2
SCHEMBL28747980 0.78 KDM4E (0.65) KDM4EF13A1GAANPC1CYP1A2
SCHEMBL2379821 0.78 KDM4E (0.65) KDM4EF13A1GAANPC1CYP1A2
SCHEMBL2191045 0.78 KDM4E (0.65) KDM4EF13A1GAANPC1CYP1A2

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-11124822-B2 Enhanced biomolecule detection assays based on tyramide signal amplification and gammaPNA probes CARNEGIE MELLON UNIVERSITY (US) 2021-09-21 US disclosed
US-20170226572-A1 Enhanced Biomolecule Detection Assays Based on Tyramide Signal Amplification and gammaPNA Probes CARNEGIE MELLON UNIVERSITY 2017-08-10 US disclosed