SCHEMBL29670987

SCHEMBL29670987

COc1ccc2c(c1)NCCN2C(=O)NC1CCCCC1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.51
KMT2A Q03164 5/20 0.50
MEN1 O00255 4/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
GFER P55789 1/20 0.50
ALDH1A1 P00352 4/20 0.48
TDP1 Q9NUW8 1/20 0.48
RAB9A P51151 4/20 0.46
NPC1 O15118 4/20 0.46
TSHR P16473 1/20 0.46
GAA P10253 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
EPHX2 P34913 2/20 0.44
EPHX1 P07099 1/20 0.44
KDM4E B2RXH2 1/20 0.44
HPGD P15428 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL28707733 1.00 MAPT (0.51) MAPTKMT2AMEN1SMN1; SMN2GFER
SCHEMBL28719380 0.80 MAPT (0.55) MAPTKMT2ASMN1; SMN2ALDH1A1TDP1
SCHEMBL29670976 0.80 MAPT (0.55) MAPTKMT2ASMN1; SMN2ALDH1A1TDP1
SCHEMBL28937215 0.80 MMP2 (0.52) MAPTSMN1; SMN2ALDH1A1RAB9ANPC1
SCHEMBL29670974 0.80 MMP2 (0.52) MAPTSMN1; SMN2ALDH1A1RAB9ANPC1
SCHEMBL28719007 0.79 MMP2 (0.46) MAPTSMN1; SMN2ALDH1A1RAB9ANPC1
SCHEMBL29670975 0.79 MMP2 (0.46) MAPTSMN1; SMN2ALDH1A1RAB9ANPC1
SCHEMBL4863134 0.79 MEN1 (0.69) MAPTKMT2AMEN1SMN1; SMN2GFER
SCHEMBL28705641 0.78 MAPT (0.52) MAPTKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL29670957 0.78 MAPT (0.52) MAPTKMT2AMEN1SMN1; SMN2ALDH1A1

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