SCHEMBL10992103

SCHEMBL10992103

CCCN(CC)C(=O)c1ccccc1Nc1ccc(OC)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
TP53 P04637 1/20 0.49
ADRA1A P35348 1/20 0.48
MAPT P10636 4/20 0.47
ALOX12 P18054 1/20 0.47
MAPK1 P28482 1/20 0.47
HSD17B10 Q99714 1/20 0.47
LMNA P02545 1/20 0.45
PTGS2 P35354 2/20 0.45
ABCG2 Q9UNQ0 2/20 0.45
ALOX15 P16050 1/20 0.45
AKR1C3 P42330 2/20 0.44
AKR1C2 P52895 2/20 0.44
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 2/20 0.44
HPGD P15428 1/20 0.44
HTT P42858 2/20 0.44
RAB9A P51151 2/20 0.44
GAA P10253 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
SCHEMBL10988251 0.92 MEN1 (0.53) MEN1KMT2AMAPTALOX12MAPK1
SCHEMBL10992166 0.86 TP53 (0.53) MEN1KMT2ATP53ADRA1AMAPT
SCHEMBL10982132 0.84 MEN1 (0.52) MEN1KMT2AADRA1AMAPTALOX12
SCHEMBL10837593 0.82 ADRA1A (0.56) MEN1KMT2ATP53ADRA1AMAPT
SCHEMBL10983702 0.80 MEN1 (0.56) MEN1KMT2AMAPTALOX12MAPK1
SCHEMBL14349252 0.79 MAPT (0.57) MEN1KMT2ATP53ADRA1AMAPT
SCHEMBL10987263 0.78 MAPT (0.51) MEN1KMT2ATP53ADRA1AMAPT
SCHEMBL1499605 0.76 PTGS2 (0.59) MEN1KMT2ALMNAPTGS2ALDH1A1
SCHEMBL10989397 0.76 PTGS2 (0.64) MEN1KMT2ATP53MAPTALOX12
SCHEMBL10935935 0.76 MEN1 (0.60) MEN1KMT2AMAPTALOX12MAPK1

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