SCHEMBL22561003

SCHEMBL22561003

COc1ccc(C2C=CC(c3ccc(O)cc3)=CC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.49
APP P05067 2/20 0.42
LTA4H P09960 1/20 0.41
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
MAPT P10636 3/20 0.40
KMT2A Q03164 2/20 0.40
NPC1 O15118 2/20 0.40
MEN1 O00255 1/20 0.40
ABL1 P00519 1/20 0.38
ABCB1 P08183 1/20 0.38
BCR P11274 1/20 0.38
TP53 P04637 1/20 0.38
MAPK1 P28482 1/20 0.38
CASP3 P42574 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 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
SCHEMBL2717925 0.88 KDM1A (0.38) ESR2
SCHEMBL12707770 0.83 ACHE (0.39) MAOBMAPTKMT2ANPC1MEN1
SCHEMBL22418024 0.76 PDK2 (0.39) MAOBNPC1ABL1ABCB1BCR
SCHEMBL24619865 0.76 ESR2 (0.33) ESR2APPLTA4HMAPTKMT2A
SCHEMBL2717816 0.75 ESR1 (0.30) ESR2
SCHEMBL13564221 0.75 POLB (0.34) MAPTKMT2ANPC1MEN1MAPK1
SCHEMBL20312038 0.74 MAOA (0.41) MAOAMAOBMAPTNPC1TP53
SCHEMBL8640091 0.74 CA12 (0.38) ESR2APPMAPTKMT2ANPC1
SCHEMBL23097130 0.74 CA12 (0.38) ESR2APPMAPTKMT2ANPC1
SCHEMBL21849131 0.73 CA12 (0.37) ESR2APPMAOAMAOBMAPT

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-3725764-A1 POLYMERIZABLE COMPOUND HAVING METHOXYMETHYL ACRYLIC GROUP, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE JNC Corporation (JP) 2020-10-21 EP disclosed