SCHEMBL8346705

SCHEMBL8346705

O=C1COc2cc3ccc(O)cc3cc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.46
MAOA P21397 2/20 0.46
MIF P14174 2/20 0.42
MAPT P10636 5/20 0.42
RAB9A P51151 2/20 0.42
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
HSD17B10 Q99714 2/20 0.40
AR P10275 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
CYP1A2 P05177 2/20 0.40
NPC1 O15118 1/20 0.40
CYP2C9 P11712 1/20 0.40
PKM P14618 1/20 0.40
CYP2C19 P33261 1/20 0.40
KDM4E B2RXH2 1/20 0.39
GLA P06280 1/20 0.39
HPGD P15428 1/20 0.39
CA12 O43570 1/20 0.39

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
SCHEMBL29409544 0.80 MAOB (0.68) MAOBMAOAMIFMAPTRAB9A
SCHEMBL30337075 0.80 MAPT (0.60) MAOBMAOAMIFMAPTRAB9A
SCHEMBL563933 0.80 MAOB (0.68) MAOBMAOAMIFMAPTRAB9A
SCHEMBL3223921 0.80 MAPT (0.60) MAOBMAOAMIFMAPTRAB9A
SCHEMBL86315 0.80 MAOA (0.50) MAOBMAOAMAPTRAB9AALDH1A1
SCHEMBL3198655 0.79 ALDH1A1 (0.41) MAOBMAOAMIFMAPTRAB9A
SCHEMBL30948395 0.77 ALOX5 (0.41) MAOBMAOAMAPTALDH1A1MEN1
SCHEMBL26777075 0.76 MAOB (0.57) MAOBMAOAMIFMAPTRAB9A
SCHEMBL7121782 0.72 CYP3A4 (0.65) MAOBMAOAMAPTALDH1A1MEN1
SCHEMBL26205026 0.72 ESR2 (0.62) MAOBMAOAMAPTRAB9AALDH1A1

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
WO-1999024438-A1 HETEROCYCLIC ANNEALED PHOTOCHROMIC 2H- AND 3H-NAPHTOPYRAN SYSTEMS, METHOD FOR PRODUCING THE SAME AND USE THEREOF OPTISCHE WERKE G. RODENSTOCK (DE) 1999-05-20 WO disclosed