SCHEMBL10987315

SCHEMBL10987315

CN(C)C(=O)c1ccccc1Nc1ccc(O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 2/20 0.53
SIRT2 Q8IXJ6 4/20 0.51
MT-CO2 P00403 2/20 0.50
MAPT P10636 2/20 0.49
ALOX15 P16050 1/20 0.49
MAPK9 P45984 1/20 0.48
MAPK10 P53779 1/20 0.48
FABP4 P15090 1/20 0.47
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
GAA P10253 1/20 0.46
PKM P14618 1/20 0.46
MAPK1 P28482 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
POLB P06746 1/20 0.46
AURKA O14965 1/20 0.45
MAPK8 P45983 1/20 0.45
AURKB Q96GD4 1/20 0.45
PTGS1 P23219 1/20 0.44
AKR1C3 P42330 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
SCHEMBL10987377 0.85 MT-CO2 (0.49) CXCR2SIRT2MT-CO2MAPTALOX15
SCHEMBL10987263 0.83 MAPT (0.51) SIRT2MT-CO2MAPTALOX15FABP4
SCHEMBL10983702 0.83 MEN1 (0.56) SIRT2MT-CO2MAPTALOX15MEN1
SCHEMBL10838240 0.83 MAPK9 (0.53) CXCR2SIRT2MAPTALOX15MAPK9
SCHEMBL10992516 0.82 MAPT (0.64) SIRT2MT-CO2MAPTMEN1KMT2A
SCHEMBL10936401 0.81 MEN1 (0.58) SIRT2MT-CO2MAPTALOX15FABP4
SCHEMBL10835189 0.80 FABP4 (0.73) SIRT2MT-CO2MAPTALOX15FABP4
SCHEMBL10991979 0.79 POLB (0.63) CXCR2SIRT2MT-CO2MAPTALOX15
SCHEMBL10992166 0.79 TP53 (0.53) SIRT2MT-CO2MAPTALOX15FABP4
SCHEMBL10984674 0.78 SIRT2 (0.69) SIRT2MT-CO2FABP4

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
US-4549016-A LIPOXYGENASE INHIBITORS, ANTIALLERGENS, ANTIASTHMA AGENTS STERLING DRUG INC. (US) 1985-10-22 US disclosed
US-4510139-A ANTYIALLERGENS; ASTHMA STERLING DRUG INC. (US) 1985-04-09 US disclosed