SCHEMBL6974543

SCHEMBL6974543

Nc1cc(-c2ccccn2)ccc1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.56
ALOX15 P16050 2/20 0.56
LMNA P02545 2/20 0.56
MEN1 O00255 2/20 0.56
GAA P10253 2/20 0.56
KMT2A Q03164 2/20 0.56
USP2 O75604 1/20 0.56
ALDH1A1 P00352 1/20 0.56
HSP90AA1 P07900 1/20 0.56
MAPT P10636 1/20 0.56
HPGD P15428 1/20 0.56
ALOX12 P18054 1/20 0.56
HTT P42858 1/20 0.56
HSD17B10 Q99714 1/20 0.56
PIK3CD O00329 1/20 0.49
PIK3CA P42336 1/20 0.49
PI4KA P42356 1/20 0.49
PIK3CG P48736 1/20 0.49
PI4KB Q9UBF8 1/20 0.49
KDM1A O60341 3/20 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
SCHEMBL17772058 0.86 ALOX15 (0.55) KDM4EALOX15LMNAMEN1GAA
SCHEMBL11341702 0.83 PI4KA (0.53) KDM4EALOX15LMNAMEN1KMT2A
SCHEMBL10756157 0.83 POLB (0.54) KDM4ELMNAMEN1GAAKMT2A
Bromide SCHEMBL11334286 0.81 POLB (0.52) KDM4ELMNAMEN1GAAKMT2A
SCHEMBL24150006 0.79 PIK3CD (0.47) KDM4EALOX15LMNAMEN1GAA
SCHEMBL172718 0.79 HSD17B1 (0.51) KDM4ELMNAPOLBCYP1A2CCR1
SCHEMBL6506946 0.79 KDM4E (0.50) KDM4EALOX15LMNAALDH1A1MAPT
SCHEMBL3027291 0.79 NPC1 (0.50) KDM4EALOX15LMNAMEN1KMT2A
Bromide SCHEMBL17744696 0.77 HSD17B1 (0.50) KDM4ELMNAPOLBCYP1A2CCR1
SCHEMBL30596191 0.77 BACE1 (0.50) KDM4ELMNAALDH1A1MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0708769-B1 SUBSTITUTED 2-FUSED PHENYLPYRIDINES WITH HERBICIDAL ACTIVITY BASF AG (DE) 2003-01-29 EP claimed
EP-0708769-A1 SUBSTITUTED 2-FUSED PHENYLPYRIDINES WITH HERBICIDAL ACTIVITY BASF AKTIENGESELLSCHAFT (DE) 1996-05-01 EP claimed
WO-1995002590-A2 SUBSTITUTED 2-FUSED PHENYLPYRIDINES WITH HERBICIDAL ACTIVITIES BASF AKTIENGESELLSCHAFT (DE) 1995-01-26 WO claimed
CN-1127507-A Substituted 2-fused phenylpyridines with herbicidal activity BASF AG (DE) 1996-07-24 CN disclosed
US-4366319-A Process for preparing 5-(pyridinyl)benzoxazol-2(3H)-ones STERLING DRUG INC. (US) 1982-12-28 US disclosed
US-4310531-A 5-(Pyridinyl)-benzoxazol-2(3H)-ones and their use as cardiotonics STERLING DRUG INC. (US) 1982-01-12 US disclosed
US-4297363-A 2-Amino-3(4 or 5)-(pyridinyl)phenols and their use as cardiotonics STERLING DRUG INC. (US) 1981-10-27 US disclosed