SCHEMBL7055321

SCHEMBL7055321

CON=C(C)c1cc2c(C(=O)Oc3ccc([N+](=O)[O-])cc3)ccc(OC)c2o1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.43
ALDH1A1 P00352 4/20 0.43
KMT2A Q03164 2/20 0.43
RAB9A P51151 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KDM4E B2RXH2 3/20 0.42
LMNA P02545 2/20 0.41
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PDE4A P27815 5/20 0.41
PDE4B Q07343 5/20 0.41
PDE4C Q08493 5/20 0.41
PDE4D Q08499 5/20 0.41
GAA P10253 2/20 0.39
PKM P14618 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL7055317 1.00 MAPT (0.43) MAPTALDH1A1KMT2ARAB9AL3MBTL1
SCHEMBL7055316 1.00 MAPT (0.43) MAPTALDH1A1KMT2ARAB9AL3MBTL1
SCHEMBL7425562 0.83 ALDH1A1 (0.43) MAPTALDH1A1KMT2ARAB9AL3MBTL1
SCHEMBL7050093 0.80 PDE4A (0.48) MAPTALDH1A1KMT2ARAB9AL3MBTL1
SCHEMBL6609206 0.79 ALDH1A1 (0.45) MAPTALDH1A1KMT2ARAB9AL3MBTL1
SCHEMBL7050590 0.79 RAB9A (0.43) MAPTALDH1A1KMT2ARAB9AL3MBTL1
SCHEMBL7053230 0.78 PDE4A (0.50) MAPTALDH1A1KMT2ARAB9AKDM4E
SCHEMBL7053234 0.78 PDE4A (0.50) MAPTALDH1A1KMT2ARAB9AKDM4E
SCHEMBL7053236 0.78 PDE4A (0.50) MAPTALDH1A1KMT2ARAB9AKDM4E
SCHEMBL7054767 0.77 PDE4A (0.46) MAPTALDH1A1KMT2ALMNAPDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0901482-B1 BENZOFURAN CARBOXAMIDES AND THEIR THERAPEUTIC USE DARWIN DISCOVERY LTD (GB) 2003-05-02 EP disclosed