SCHEMBL30856565

SCHEMBL30856565

O=C(CO)Nc1cccc(NC(=O)CO)n1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.61
KMT2A Q03164 4/20 0.52
MEN1 O00255 3/20 0.52
HPGD P15428 2/20 0.52
RAB9A P51151 5/20 0.51
NPC1 O15118 4/20 0.51
POLB P06746 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
RXFP1 Q9HBX9 1/20 0.48
GAA P10253 1/20 0.47
JAK2 O60674 1/20 0.44
TYK2 P29597 1/20 0.44
ALDH1A1 P00352 2/20 0.44
HSD17B10 Q99714 2/20 0.43
KDM4E B2RXH2 1/20 0.43
TP53 P04637 1/20 0.43

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
SCHEMBL13841479 0.87 RAB9A (0.68) SMN1; SMN2KMT2AMEN1RAB9ANPC1
SCHEMBL22417702 0.81 SMN1; SMN2 (0.59) SMN1; SMN2KMT2AMEN1HPGDRAB9A
SCHEMBL4551457 0.81 SMN1; SMN2 (0.65) SMN1; SMN2KMT2AMEN1HPGDRAB9A
SCHEMBL431802 0.79 SMN1; SMN2 (0.58) SMN1; SMN2KMT2AMEN1HPGDRAB9A
SCHEMBL4491035 0.78 GAA (0.79) SMN1; SMN2KMT2AMEN1RAB9ANPC1
SCHEMBL821743 0.78 SMN1; SMN2 (0.61) SMN1; SMN2HPGDRAB9ANPC1GAA
SCHEMBL11716649 0.77 NPC1 (0.66) SMN1; SMN2KMT2ARAB9ANPC1
SCHEMBL12934604 0.76 NPC1 (0.67) SMN1; SMN2HPGDRAB9ANPC1RXFP1
SCHEMBL15305700 0.75 SMN1; SMN2 (0.58) SMN1; SMN2HPGDRAB9ANPC1GAA
SCHEMBL430530 0.75 SMN1; SMN2 (0.53) SMN1; SMN2KMT2AMEN1HPGDRAB9A

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
CN-117736567-A Room temperature self-repairing elastic conductor and preparation method and application thereof 中国科学院宁波材料技术与工程研究所 2024-03-22 CN claimed
CN-117736567-A Room temperature self-repairing elastic conductor and preparation method and application thereof 中国科学院宁波材料技术与工程研究所 2024-03-22 CN disclosed