SCHEMBL5823951

SCHEMBL5823951

C=CCNc1ccccc1B(O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.40
MEN1 O00255 2/20 0.40
ALDH1A1 P00352 4/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
TP53 P04637 1/20 0.37
RRM2 P31350 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
RAB9A P51151 3/20 0.36
MAPT P10636 2/20 0.36
GAA P10253 1/20 0.36
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
MITF O75030 1/20 0.36
NSD2 O96028 1/20 0.36
LMNA P02545 1/20 0.36
CASP3 P42574 1/20 0.36
HTT P42858 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36

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
SCHEMBL28069464 0.86 KMT2A (0.38) KMT2AMEN1ALDH1A1L3MBTL1TP53
SCHEMBL4784858 0.80 ALDH1A1 (0.44) KMT2AMEN1ALDH1A1L3MBTL1TP53
SCHEMBL3786294 0.76 IDO1 (0.46) KMT2AMEN1SMN1; SMN2RAB9AMAPT
SCHEMBL29953234 0.76 IDO1 (0.46) KMT2AMEN1SMN1; SMN2RAB9AMAPT
SCHEMBL796531 0.75 KMT2A (0.48) KMT2AMEN1ALDH1A1L3MBTL1RRM2
SCHEMBL20296892 0.75 ENPP2 (0.38) ALDH1A1MAPTHTT
SCHEMBL1485712 0.75 MAPT (0.59) KMT2AMEN1ALDH1A1L3MBTL1TP53
SCHEMBL26064904 0.74 CA12 (0.41) KMT2AMEN1ALDH1A1L3MBTL1TP53
SCHEMBL5824157 0.74 KMT2A (0.49) KMT2AMEN1ALDH1A1L3MBTL1RRM2
SCHEMBL9287668 0.73 ADRA2B (0.51) KMT2AMEN1ALDH1A1L3MBTL1RRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9994615-B2 Self-regulated peptide hydrogel for insulin delivery MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2018-06-12 US disclosed
US-20150025005-A1 SELF-REGULATED PEPTIDE HYDROGEL FOR INSULIN DELIVERY MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2015-01-22 US disclosed
EP-2814459-A1 SELF-REGULATED PEPTIDE HYDROGEL FOR INSULIN DELIVERY Massachusetts Institute Of Technology (US) 2014-12-24 EP disclosed
WO-2013123491-A1 SELF-REGULATED PEPTIDE HYDROGEL FOR INSULIN DELIVERY MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2013-08-22 WO disclosed
WO-2006102762-A1 GLUCOSE RESPONSIVE MICROGELS MCMASTER UNIVERSITY (CA) 2006-10-05 WO disclosed