SCHEMBL8495376

SCHEMBL8495376

O=C(Oc1c(O)c2cc(O)ccc2oc1=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.49
ALDH1A1 P00352 2/20 0.49
MAPT P10636 2/20 0.49
MEN1 O00255 2/20 0.49
GAA P10253 2/20 0.49
NPSR1 Q6W5P4 2/20 0.49
LMNA P02545 1/20 0.49
HTT P42858 1/20 0.49
MAOA P21397 2/20 0.47
MAOB P27338 2/20 0.47
ESR1 P03372 1/20 0.45
ESR2 Q92731 1/20 0.45
MIF P14174 2/20 0.44
HPGD P15428 1/20 0.44
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
CALM1 P0DP23 1/20 0.44
PKM P14618 1/20 0.44
FTO Q9C0B1 1/20 0.44
CA12 O43570 3/20 0.43

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
SCHEMBL8490618 0.90 MAP1LC3B (0.53) KMT2AALDH1A1MAPTMEN1GAA
SCHEMBL12903267 0.86 ALDH1A1 (0.60) KMT2AALDH1A1MAPTMEN1GAA
SCHEMBL8492647 0.85 NQO1 (0.55) KMT2AALDH1A1MAPTMEN1GAA
SCHEMBL8491606 0.83 NPSR1 (0.52) KMT2AALDH1A1MAPTMEN1GAA
SCHEMBL8490540 0.82 NQO1 (0.52) KMT2AALDH1A1MAPTMEN1GAA
SCHEMBL8494429 0.81 CA12 (0.46) KMT2AMAPTMEN1GAAMAOA
SCHEMBL8496994 0.79 GAA (0.49) KMT2AALDH1A1MAPTMEN1GAA
SCHEMBL8497342 0.79 GAA (0.49) KMT2AALDH1A1MAPTMEN1GAA
SCHEMBL8490229 0.78 MAOA (0.48) KMT2AALDH1A1MAPTGAALMNA
SCHEMBL8492630 0.78 NPSR1 (0.47) KMT2AALDH1A1MAPTMEN1GAA

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-0598117-B1 BENZOPYRAN DERIVATIVE AND ANTIALLERGIC AGENT CONTAINING THE SAME AS ACTIVE INGREDIENT DAINIPPON INK & CHEMICALS (JP) 1999-06-30 EP disclosed
US-5428059-A Benzopyran derivatives and an anti-allergic agent possessing the same as the active ingredient DAINIPPON INK & CHEMICALS, INC. (JP) 1995-06-27 US disclosed
EP-0598117-A1 BENZOPYRAN DERIVATIVE AND ANTIALLERGIC AGENT CONTAINING THE SAME AS ACTIVE INGREDIENT DAINIPPON INK AND CHEMICALS, INC. (JP) 1994-05-25 EP disclosed