SCHEMBL8313694

SCHEMBL8313694

CCOC(=O)C1=CC(CF)(CF)Oc2ccc(Cl)cc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALPG P10696 1/20 0.41
MAOB P27338 1/20 0.39
ALOX15 P16050 5/20 0.38
MAPK1 P28482 2/20 0.38
MAPT P10636 3/20 0.37
NPC1 O15118 1/20 0.37
POLB P06746 1/20 0.37
TSHR P16473 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ALDH1A1 P00352 3/20 0.37
TP53 P04637 1/20 0.37
DPP4 P27487 1/20 0.37
DPP8 Q6V1X1 1/20 0.37
DPP9 Q86TI2 1/20 0.37
KDM4E B2RXH2 3/20 0.36
KMT2A Q03164 1/20 0.36
ABCC1 P33527 1/20 0.36
CYP1A2 P05177 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
SCHEMBL6269700 0.86 ALDH1A1 (0.36) MAPTTSHRHSD17B10ALDH1A1KDM4E
SCHEMBL6269237 0.86 LMNA (0.40) ALOX15MAPK1MAPTNPC1RAB9A
Hydrochloric Acid SCHEMBL8316265 0.85 LMNA (0.40) ALOX15MAPK1MAPTNPC1RAB9A
SCHEMBL8313997 0.83 MAPT (0.49) MAPTTSHRSMN1; SMN2ALDH1A1KDM4E
SCHEMBL8314899 0.82 ALDH1A1 (0.36) ALPGMAPTTSHRSMN1; SMN2HSD17B10
SCHEMBL6268793 0.82 ALDH1A1 (0.33) ALPGMAPTHSD17B10ALDH1A1KDM4E
SCHEMBL8313550 0.81 ALDH1A1 (0.35) ALPGALOX15MAPTNPC1POLB
SCHEMBL6269249 0.80 MLYCD (0.32) MAPTPOLBHSD17B10ALDH1A1KDM4E
SCHEMBL8316142 0.79 KMT2A (0.35) MAPTPOLBALDH1A1KDM4EKMT2A
SCHEMBL8313695 0.72 KDM4E (0.34) ALPGMAPTNPC1POLBRAB9A

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-0632033-B1 NOVEL BENZOPYRAN DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 1999-04-07 EP disclosed
US-5646308-A POTASSIUM CHANNEL ACTIVATORS USED AS ANTIASTHMATICS, ANTIEPILEPTICS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 1997-07-08 US disclosed
EP-0632033-A1 NOVEL BENZOPYRAN DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 1995-01-04 EP disclosed