SCHEMBL8044644

SCHEMBL8044644

COc1ccc(N=Nc2ccc(Nc3ccccc3)cc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 6/20 0.63
▸ MAPT P10636 5/20 0.63
▸ NPC1 O15118 4/20 0.63
▸ TDP1 Q9NUW8 4/20 0.63
▸ MAPK1 P28482 3/20 0.63
▸ GAA P10253 3/20 0.63
▸ L3MBTL1 Q9Y468 3/20 0.63
▸ KDM4E B2RXH2 2/20 0.63
▸ THRB P10828 2/20 0.63
▸ RECQL P46063 2/20 0.63
▸ NPSR1 Q6W5P4 1/20 0.63
▸ KMT2A Q03164 4/20 0.54
▸ MEN1 O00255 3/20 0.54
▸ NR4A1 P22736 1/20 0.53
▸ HSD17B10 Q99714 3/20 0.53
▸ ALOX12 P18054 2/20 0.53
▸ CYP1A2 P05177 2/20 0.51
▸ CYP2C19 P33261 2/20 0.51
▸ ALDH1A1 P00352 4/20 0.50
▸ CYP3A4 P08684 2/20 0.50

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
SCHEMBL28233592 0.96 MAPT (0.63) RAB9AMAPTNPC1TDP1MAPK1
SCHEMBL28233594 0.96 MAPT (0.63) RAB9AMAPTNPC1TDP1MAPK1
SCHEMBL316390 0.88 RAB9A (0.81) RAB9AMAPTNPC1TDP1MAPK1
SCHEMBL9479393 0.88 RAB9A (0.81) RAB9AMAPTNPC1TDP1MAPK1
Hydrochloric Acid SCHEMBL7128947 0.86 RAB9A (0.77) RAB9AMAPTNPC1TDP1MAPK1
SCHEMBL1405136 0.84 CA4 (0.59) RAB9AMAPTNPC1TDP1MAPK1
SCHEMBL1405134 0.84 CA4 (0.59) RAB9AMAPTNPC1TDP1MAPK1
SCHEMBL10160621 0.82 MAPT (0.71) RAB9AMAPTNPC1TDP1MAPK1
SCHEMBL2437660 0.82 ALDH1A1 (0.65) RAB9AMAPTNPC1TDP1MAPK1
SCHEMBL61806 0.82 ALDH1A1 (0.65) RAB9AMAPTNPC1TDP1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0726889-B1 PROCESS FOR PREPARING SUBSTITUTED AROMATIC AMINES MONSANTO CO (US) 2000-04-12 — — EP disclosed
EP-0696269-B1 PROCESS FOR PREPARING SUBSTITUTED AROMATIC AMINES MONSANTO CO (US) 1999-06-30 — — EP disclosed
US-5633407-A Process for preparing substituted aromatic amines FLEXSYS AMERICA L. P. (US) 1997-05-27 — — US disclosed
US-5618979-A REACTING NUCLEOPHILIC AMINE AND AMIDE WITH SUBSTITUTED AROMATIC AZO COMPOUND OR AZOXY OR HYDRAZINO COMPOUND FLEXSYS AMERICA L. P. (US) 1997-04-08 — — US disclosed
EP-0641313-B1 PROCESS FOR PREPARING SUBSTITUTED AROMATIC AMINES MONSANTO CO (US) 1997-01-22 — — EP disclosed
US-5552531-A USED IN THE PRODUCTION OF AROMATIC AMINES, REACTING A NUCLEOPHILIC ANILINE, OR AMIDE OR AMINE WITH AN AZO COMPOUND MONSANTO COMPANY (US) 1996-09-03 — — US disclosed
EP-0726889-A1 PROCESS FOR PREPARING SUBSTITUTED AROMATIC AMINES MONSANTO COMPANY (US) 1996-08-21 — — EP disclosed
EP-0696269-A1 PROCESS FOR PREPARING SUBSTITUTED AROMATIC AMINES MONSANTO COMPANY (US) 1996-02-14 — — EP disclosed
US-5451702-A Process for preparing substituted aromatic amines MONSANTO COMPANY (US) 1995-09-19 — — US disclosed
WO-1995012569-A1 PROCESS FOR PREPARING SUBSTITUTED AROMATIC AMINES MONSANTO COMPANY (US) 1995-05-11 — — WO disclosed
EP-0641313-A1 PROCESS FOR PREPARING SUBSTITUTED AROMATIC AMINES. MONSANTO CO (US) 1995-03-08 — — EP disclosed
US-5382691-A Process for preparing substituted aromatic amines MONSANTO COMPANY (US) 1995-01-17 — — US disclosed
WO-1994025425-A1 PROCESS FOR PREPARING SUBSTITUTED AROMATIC AMINES MONSANTO COMPANY (US) 1994-11-10 — — WO disclosed
WO-1993024450-A1 PROCESS FOR PREPARING SUBSTITUTED AROMATIC AMINES MONSANTO COMPANY (US) 1993-12-09 — — WO disclosed
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