SCHEMBL28759686

SCHEMBL28759686

NC(=O)c1ccc(N)cc1.Nc1ccccc1N

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 7/20 0.61
CYP3A4 P08684 3/20 0.58
MAPT P10636 2/20 0.58
PARP1 P09874 2/20 0.58
CYP2C19 P33261 2/20 0.58
POLB P06746 1/20 0.58
TSHR P16473 1/20 0.58
RECQL P46063 1/20 0.58
BLM P54132 1/20 0.58
PMP22 Q01453 1/20 0.58
HSD17B10 Q99714 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
PLA2G10 O15496 1/20 0.50
PLA2G2A P14555 1/20 0.50
ALDH1A1 P00352 2/20 0.46
KMT2A Q03164 2/20 0.46
PARP4 Q9UKK3 2/20 0.46
PARP15 Q460N3 1/20 0.46
PARP14 Q460N5 1/20 0.46

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
Terephthalamide SCHEMBL221067 0.93 CYP3A4 (0.67) PARP10CYP3A4MAPTPARP1CYP2C19
Aniline SCHEMBL28319061 0.88 TSHR (0.68) PARP10CYP3A4MAPTPARP1CYP2C19
Benzene SCHEMBL28558933 0.88 PARP10 (0.68) PARP10CYP3A4MAPTPARP1CYP2C19
Benzene SCHEMBL6865184 0.88 PARP10 (0.68) PARP10CYP3A4MAPTPARP1CYP2C19
Terephthalamide SCHEMBL437011 0.88 PARP10 (0.74) PARP10CYP3A4MAPTPARP1CYP2C19
SCHEMBL56532 0.88 PARP10 (0.74) PARP10CYP3A4MAPTPARP1CYP2C19
SCHEMBL7642130 0.88 PARP10 (0.74) PARP10CYP3A4MAPTPARP1CYP2C19
Benzamide SCHEMBL27352223 0.86 TSHR (0.80) PARP10CYP3A4MAPTPARP1CYP2C19
Benzamide SCHEMBL4016379 0.86 PARP1 (0.80) PARP10CYP3A4MAPTPARP1CYP2C19
Terephthalamide SCHEMBL28128192 0.86 TSHR (0.71) PARP10CYP3A4MAPTPARP1CYP2C19

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-114621440-A High-temperature-resistant polyamide-polyetherimide toughened polymer and preparation method thereof 苏州予信天材新材料应用技术有限公司 2022-06-14 CN claimed
CN-114621440-A High-temperature-resistant polyamide-polyetherimide toughened polymer and preparation method thereof 苏州予信天材新材料应用技术有限公司 2022-06-14 CN disclosed