SCHEMBL7471877

SCHEMBL7471877

Clc1cccc2c(Oc3ccccc3Br)ccnc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.41
LMNA P02545 1/20 0.41
NR1H2 P55055 1/20 0.41
NR1H3 Q13133 1/20 0.41
KDM4E B2RXH2 6/20 0.41
ALDH1A1 P00352 3/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
HTT P42858 2/20 0.39
HSD17B10 Q99714 1/20 0.39
MAPK1 P28482 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPT P10636 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
GAA P10253 1/20 0.38
AR P10275 2/20 0.36
AURKA O14965 1/20 0.36

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
SCHEMBL7458487 0.88 NR4A2 (0.41) NR4A2SMN1; SMN2LMNAKDM4EALDH1A1
SCHEMBL7466638 0.88 NR4A2 (0.53) NR4A2SMN1; SMN2LMNANR1H2NR1H3
SCHEMBL7531657 0.87 NR4A2 (0.59) NR4A2SMN1; SMN2LMNANR1H2NR1H3
SCHEMBL7465640 0.85 NR4A2 (0.42) NR4A2SMN1; SMN2LMNANR1H2NR1H3
SCHEMBL7462376 0.85 ALDH1A1 (0.49) NR4A2SMN1; SMN2LMNANR1H2NR1H3
SCHEMBL7461220 0.82 NR4A2 (0.47) NR4A2SMN1; SMN2LMNAKDM4EALDH1A1
SCHEMBL7464651 0.82 NR4A2 (0.47) NR4A2SMN1; SMN2NR1H2NR1H3KDM4E
SCHEMBL7464015 0.82 NR4A2 (0.47) NR4A2SMN1; SMN2LMNANR1H2NR1H3
SCHEMBL7465295 0.82 KDM4E (0.58) NR4A2SMN1; SMN2NR1H2NR1H3KDM4E
SCHEMBL7464982 0.80 L3MBTL1 (0.46) NR4A2SMN1; SMN2LMNAKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0326330-B1 Quinoline fungicides DOW AGROSCIENCES LLC (US) 2002-07-24 EP claimed
US-5145843-A For plants DOWELANCO (US) 1992-09-08 US claimed
EP-0326330-B1 Quinoline fungicides DOW AGROSCIENCES LLC (US) 2002-07-24 EP disclosed
US-5240940-A Synergistic nmixture DOWELANCO (US) 1993-08-31 US disclosed
US-5145843-A For plants DOWELANCO (US) 1992-09-08 US disclosed
EP-0326330-A2 Quinoline, quinazoline, and cinnoline fungicides DowElanco (US) 1989-08-02 EP disclosed