SCHEMBL3922244

SCHEMBL3922244

CC(Cc1ccc(Oc2ccc(N)cc2)cc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.53
RAB9A P51151 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
NPC1 O15118 1/20 0.49
NLRP3 Q96P20 1/20 0.49
ALDH1A1 P00352 3/20 0.45
TDP1 Q9NUW8 2/20 0.45
CYP3A4 P08684 1/20 0.45
TSHR P16473 1/20 0.45
ESR1 P03372 1/20 0.43
ESR2 Q92731 1/20 0.43
TAAR1 Q96RJ0 2/20 0.43
TEAD4 Q15561 1/20 0.43
MAPT P10636 3/20 0.42
GAA P10253 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MAOB P27338 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
POLB P06746 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
SCHEMBL3922242 0.94 MAOA (0.53) MAOARAB9AMEN1KMT2ANPC1
SCHEMBL1856444 0.92 ESR1 (0.52) MAOARAB9AMEN1KMT2ANPC1
SCHEMBL29263288 0.92 ESR1 (0.52) MAOARAB9AMEN1KMT2ANPC1
SCHEMBL8732205 0.90 TAAR1 (0.52) MAOARAB9ANPC1ESR1ESR2
Ammonia Solution, Strong SCHEMBL21635043 0.88 TAAR1 (0.50) MAOARAB9ANPC1ESR1ESR2
SCHEMBL8583523 0.83 TAAR1 (0.52) MAOARAB9ANPC1ESR1ESR2
SCHEMBL29436304 0.81 MAOB (0.54) MEN1KMT2AALDH1A1CYP3A4ESR1
SCHEMBL7865335 0.81 MAOB (0.54) MEN1KMT2AALDH1A1CYP3A4ESR1
SCHEMBL23930286 0.81 MAOA (0.53) MAOARAB9AMEN1KMT2ANPC1
SCHEMBL5949977 0.80 ESR1 (0.63) ALDH1A1TDP1CYP3A4TSHRESR1

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2032644-A2 COMPOSITIONS AND METHODS FOR POLYMER COMPOSITES Sabic Innovative Plastics IP B.V. (NL) 2009-03-11 EP disclosed
EP-2032641-A2 PHOSPHONIUM SALTS FOR POLYMER COMPOSITES AND THEIR PREPARATION Sabic Innovative Plastics IP B.V. (NL) 2009-03-11 EP disclosed
EP-2032639-A2 PYRIDINIUM SALTS FOR POLYMER COMPOSITES AND METHODS FOR THEIR PREPARATION Sabic Innovative Plastics IP B.V. (NL) 2009-03-11 EP disclosed
EP-2032635-A2 COMPOSITIONS AND METHODS FOR POLYMER COMPOSITES Sabic Innovative Plastics IP B.V. (NL) 2009-03-11 EP disclosed
EP-2032643-A2 COMPOSITIONS AND METHODS FOR POLYMER COMPOSITES Sabic Innovative Plastics IP B.V. (NL) 2009-03-11 EP disclosed
EP-2032630-A2 COMPOSITIONS AND METHODS FOR POLYMER COMPOSITES Sabic Innovative Plastics IP B.V. (NL) 2009-03-11 EP disclosed
EP-2032642-A2 COMPOSITIONS AND METHODS FOR POLYMER COMPOSITES Sabic Innovative Plastics IP B.V. (NL) 2009-03-11 EP disclosed
EP-2032646-A2 COMPOSITIONS AND METHODS FOR POLYMER COMPOSITES Sabic Innovative Plastics IP B.V. (NL) 2009-03-11 EP disclosed
EP-2032640-A2 COMPOSITIONS AND METHODS FOR POLYMER COMPOSITES Sabic Innovative Plastics IP B.V. (NL) 2009-03-11 EP disclosed
EP-2032645-A2 COMPOSITIONS AND METHODS FOR POLYMER COMPOSITES Sabic Innovative Plastics IP B.V. (NL) 2009-03-11 EP disclosed
WO-2008002880-A2 COMPOSITIONS AND METHODS FOR POLYMER COMPOSITES SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2008-01-03 WO disclosed
WO-2008002890-A2 COMPOSITIONS AND METHODS FOR POLYMER COMPOSITES SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2008-01-03 WO disclosed
WO-2008002869-A2 COMPOSITIONS AND METHODS FOR POLYMER COMPOSITES SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2008-01-03 WO disclosed
WO-2008002889-A2 COMPOSITIONS AND METHODS FOR POLYMER COMPOSITES SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2008-01-03 WO disclosed
WO-2008002886-A2 PHOSPHONIUM SALTS FOR POLYMER COMPOSITES AND THEIR PREPARATION SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2008-01-03 WO disclosed
WO-2008002866-A2 COMPOSITIONS AND METHODS FOR POLYMER COMPOSITES SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2008-01-03 WO disclosed
WO-2008002867-A2 COMPOSITIONS AND METHODS FOR POLYMER COMPOSITES SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2008-01-03 WO disclosed
WO-2008002887-A2 COMPOSITIONS AND METHODS FOR POLYMER COMPOSITES SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2008-01-03 WO disclosed
WO-2008002888-A2 COMPOSITIONS AND METHODS FOR POLYMER COMPOSITES SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2008-01-03 WO disclosed
WO-2008002868-A2 PYRIDINIUM SALTS FOR POLYMER COMPOSITES AND METHODS FOR THEIR PREPARATION SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2008-01-03 WO disclosed