SCHEMBL8136759

SCHEMBL8136759

COC(=O)c1ccc2c(c1)CCc1ccccc1C2O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.48
MEN1 O00255 6/20 0.48
MAPT P10636 1/20 0.48
TRPA1 O75762 3/20 0.47
CHRNB2 P17787 1/20 0.46
CHRNA4 P43681 1/20 0.46
RAB9A P51151 1/20 0.46
ALDH1A1 P00352 1/20 0.44
PDE4A P27815 1/20 0.44
PDE4B Q07343 1/20 0.44
PDE4C Q08493 1/20 0.44
PDE4D Q08499 1/20 0.44
TSHR P16473 1/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
XDH P47989 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42

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
SCHEMBL13548830 0.94 CHRNB2 (0.50) KMT2AMEN1MAPTTRPA1CHRNB2
SCHEMBL9316791 0.91 KMT2A (0.48) KMT2AMEN1MAPTTRPA1RAB9A
SCHEMBL12050809 0.85 MAPK14 (0.44) KMT2AMEN1MAPTCHRNB2CHRNA4
SCHEMBL13550866 0.84 TRPA1 (0.51) KMT2AMEN1MAPTTRPA1CHRNB2
SCHEMBL13548841 0.83 CHRNB2 (0.49) KMT2AMEN1MAPTTRPA1CHRNB2
SCHEMBL13806823 0.82 SMN1; SMN2 (0.43) KMT2AMEN1MAPTCHRNB2CHRNA4
SCHEMBL8879358 0.81 SRD5A2 (0.58) KMT2AALDH1A1
SCHEMBL8137630 0.79 KMT2A (0.40) KMT2AMEN1MAPTTRPA1CHRNB2
SCHEMBL16499816 0.79 CHRNB2 (0.48) KMT2AMEN1MAPTCHRNB2CHRNA4
SCHEMBL31511361 0.79 CHRNB2 (0.48) KMT2AMEN1MAPTCHRNB2CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0549352-B1 Tricyclic compounds as angiotensin II antagonists KYOWA HAKKO KOGYO KK (JP) 2000-03-01 EP disclosed
US-5478840-A Imidazo(4,5-b)pyridine derivatives used as antagonism to angiotensin ii receptors KYOWA HAKKO KOGYO CO., LTD. (JP) 1995-12-26 US disclosed
US-5378701-A Angiotensin II inhibitors; hypotensive agents; congestive heart and kidney failure; glaucoma KYOWA HAKKO KOGYO (JP) 1995-01-03 US disclosed
EP-0549352-A2 Tricyclic compounds as angiotensin II antagonists KYOWA HAKKO KOGYO CO., LTD. (JP) 1993-06-30 EP disclosed