SCHEMBL10987263

SCHEMBL10987263

CCN(CC)C(=O)c1ccccc1Nc1ccc(O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.51
MT-CO2 P00403 2/20 0.50
ADRA1D P25100 1/20 0.47
ADRA1A P35348 1/20 0.47
ADRA1B P35368 1/20 0.47
ABCC1 P33527 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
ALOX15 P16050 1/20 0.45
SIRT2 Q8IXJ6 4/20 0.45
PKM P14618 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
CDK5 Q00535 1/20 0.44
CDK5R1 Q15078 1/20 0.44
FABP4 P15090 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
KEAP1 Q14145 1/20 0.43
GAA P10253 1/20 0.43
MAPK1 P28482 1/20 0.43

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
SCHEMBL10992166 0.92 TP53 (0.53) MAPTMT-CO2ADRA1DADRA1AADRA1B
SCHEMBL14349252 0.89 MAPT (0.57) MAPTMT-CO2ADRA1DADRA1AADRA1B
SCHEMBL10987377 0.87 MT-CO2 (0.49) MAPTMT-CO2ADRA1DADRA1AADRA1B
SCHEMBL10988251 0.85 MEN1 (0.53) MAPTMT-CO2ALOX15PKMNPC1
SCHEMBL10839355 0.84 ADRA1A (0.52) MAPTADRA1DADRA1AADRA1BABCC1
SCHEMBL10987315 0.83 CXCR2 (0.53) MAPTMT-CO2SMN1; SMN2ALOX15SIRT2
SCHEMBL10989940 0.81 GRM5 (0.46) MAPTMT-CO2NPC1RAB9AMEN1
SCHEMBL10992516 0.78 MAPT (0.64) MAPTMT-CO2ABCC1SIRT2NPC1
SCHEMBL27752030 0.78 ADRA1A (0.57) MAPTADRA1DADRA1AADRA1BABCC1
SCHEMBL10936401 0.78 MEN1 (0.58) MAPTMT-CO2ALOX15SIRT2PKM

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