SCHEMBL9304030

SCHEMBL9304030

Cc1cccc(NC(=O)N[C@@H](CC(=O)O)c2ccccc2)c1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.57
MEN1 O00255 2/20 0.57
MAPT P10636 1/20 0.57
ITGB3 P05106 2/20 0.51
ITGAV P06756 2/20 0.51
CYP26A1 O43174 1/20 0.51
SAE1 Q9UBE0 1/20 0.50
UBA2 Q9UBT2 1/20 0.50
MTOR P42345 1/20 0.49
ATM Q13315 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
PKM P14618 1/20 0.48
HSD17B10 Q99714 2/20 0.48
CTSA P10619 1/20 0.47
ITGA2B P08514 1/20 0.47

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
SCHEMBL9304020 1.00 KMT2A (0.57) KMT2AMEN1MAPTITGB3ITGAV
SCHEMBL9304024 1.00 KMT2A (0.57) KMT2AMEN1MAPTITGB3ITGAV
SCHEMBL9305569 0.84 MEN1 (0.47) KMT2AMEN1MAPTCYP26A1SAE1
SCHEMBL687648 0.83 MEN1 (0.48) KMT2AMEN1MAPTITGB3ITGAV
SCHEMBL19195329 0.82 KMT2A (0.60) KMT2AMEN1MAPTSAE1UBA2
SCHEMBL20335082 0.80 FPR2 (0.59) KMT2AMEN1MAPTSAE1UBA2
SCHEMBL5408556 0.78 UTS2R (0.57) CYP26A1SMN1; SMN2CTSA
SCHEMBL5409846 0.78 ROCK2 (0.64) KMT2AMEN1ITGB3HSD17B10CTSA
Toluene SCHEMBL11581740 0.77 KMT2A (0.65) KMT2AMEN1MAPTSAE1UBA2
SCHEMBL20312093 0.77 CYP26A1 (0.58) ITGB3ITGAVCYP26A1ATML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5338760-A Urea derivatives, their preparation and medicinal products containing them RHONE-POULENC RORER S.A. (FR) 1994-08-16 US disclosed