SCHEMBL11101264

SCHEMBL11101264

C=C(C(=O)O)c1c[nH]c2ccc(OC)cc2c1=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.60
ALDH1A1 P00352 4/20 0.60
LMNA P02545 3/20 0.60
HSD17B10 Q99714 2/20 0.60
HPGD P15428 1/20 0.60
NR4A2 P43354 1/20 0.59
KMT2A Q03164 3/20 0.56
MEN1 O00255 2/20 0.56
MAPT P10636 2/20 0.56
MITF O75030 1/20 0.56
RAB9A P51151 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
HTT P42858 1/20 0.54
CYP1A2 P05177 2/20 0.51
CYP2C19 P33261 2/20 0.51
CYP2C9 P11712 1/20 0.51
CPT1A P50416 1/20 0.48
POLB P06746 1/20 0.48
GAA P10253 1/20 0.48
TDP1 Q9NUW8 1/20 0.48

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
SCHEMBL2053494 0.86 HTT (0.70) KDM4EALDH1A1LMNAHSD17B10HPGD
Hydrochloric Acid SCHEMBL7514852 0.85 HTT (0.68) KDM4EALDH1A1LMNAHSD17B10HPGD
SCHEMBL29950498 0.82 LMNA (0.64) KDM4EALDH1A1LMNAHSD17B10HPGD
SCHEMBL3477919 0.82 KDM4E (0.64) KDM4EALDH1A1LMNAHSD17B10HPGD
SCHEMBL28289149 0.81 SMN1; SMN2 (0.62) KDM4EALDH1A1LMNAHSD17B10HPGD
SCHEMBL28872023 0.80 KDM4E (0.61) KDM4EALDH1A1LMNAHSD17B10HPGD
SCHEMBL592889 0.80 NR4A2 (0.77) KDM4EALDH1A1LMNAHSD17B10HPGD
SCHEMBL1558974 0.79 NR4A2 (0.71) KDM4EALDH1A1LMNAHSD17B10HPGD
SCHEMBL9725707 0.79 LMNA (0.64) KDM4EALDH1A1LMNAHSD17B10HPGD
SCHEMBL3847939 0.78 GABRA1 (0.73) KDM4EALDH1A1LMNAHSD17B10HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0055068-B1 QUINOLONE DERIVATIVES AND THEIR USE AS PHARMACEUTICALS Lilly Industries Limited (GB) 1984-10-17 EP disclosed
US-4390541-A ANTIALLERGENS; ANTISPASMODIC AGENTS LILLY INDUSTRIES LIMITED (GB) 1983-06-28 US disclosed
EP-0055068-A1 Quinolone derivatives and their use as pharmaceuticals Lilly Industries Limited (GB) 1982-06-30 EP disclosed