SCHEMBL29670979

SCHEMBL29670979

COC(=O)c1ccc2c(c1)NCCN2C(=O)Nc1ccc(C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
ALDH1A1 P00352 3/20 0.47
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
TP53 P04637 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NFKB1 P19838 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
KDM4E B2RXH2 3/20 0.43
GAA P10253 1/20 0.43
DGAT1 O75907 1/20 0.43
KDR P35968 3/20 0.42
HSD17B10 Q99714 2/20 0.42
MEN1 O00255 1/20 0.42
USP2 O75604 1/20 0.42
KMT2A Q03164 1/20 0.42
POLB P06746 1/20 0.42
LCK P06239 1/20 0.42
MET P08581 1/20 0.42

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
SCHEMBL28715924 1.00 MAPT (0.47) MAPTALDH1A1NPC1RAB9ATP53
SCHEMBL29670972 0.91 MAPT (0.49) MAPTALDH1A1NPC1RAB9ATP53
SCHEMBL28718271 0.91 MAPT (0.49) MAPTALDH1A1NPC1RAB9ATP53
SCHEMBL29670964 0.86 MAPT (0.48) MAPTALDH1A1NPC1RAB9ATP53
SCHEMBL28722560 0.86 MAPT (0.48) MAPTALDH1A1NPC1RAB9ATP53
SCHEMBL28719380 0.80 MAPT (0.55) MAPTALDH1A1NPC1RAB9ATP53
SCHEMBL29670976 0.80 MAPT (0.55) MAPTALDH1A1NPC1RAB9ATP53
SCHEMBL31620897 0.77 ALOX15 (0.43) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL28719012 0.76 MAPT (0.47) MAPTALDH1A1NPC1RAB9ATP53
SCHEMBL29670991 0.76 MAPT (0.47) MAPTALDH1A1NPC1RAB9ATP53

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-114276303-B Ureido compounds or pharmaceutically acceptable salts thereof, and preparation method and application thereof 河南大学 2023-09-22 CN disclosed
CN-114276303-A Ureido compound or its medicinal salt and its preparing process and application 河南大学 2022-04-05 CN disclosed