SCHEMBL229427

SCHEMBL229427

Cc1cccc(Nc2ccccc2)n1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.72
KMT2A Q03164 5/20 0.72
MEN1 O00255 4/20 0.72
KDM4E B2RXH2 4/20 0.72
MAPT P10636 3/20 0.72
ALPG P10696 1/20 0.72
TDP1 Q9NUW8 1/20 0.72
NPC1 O15118 3/20 0.59
GBA1 P04062 1/20 0.59
ASIC3 Q9UHC3 1/20 0.54
CYP1A2 P05177 1/20 0.53
CYP2D6 P10635 1/20 0.53
ATM Q13315 2/20 0.53
KDR P35968 1/20 0.53
ALDH1A1 P00352 2/20 0.51
HPGD P15428 2/20 0.51
ABCG2 Q9UNQ0 1/20 0.51
HSD17B10 Q99714 1/20 0.51
CHEK1 O14757 1/20 0.48
IKBKB O14920 1/20 0.48

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
SCHEMBL18162478 0.86 MAPT (0.60) RAB9AKMT2AMEN1KDM4EMAPT
SCHEMBL229747 0.84 RAB9A (0.59) RAB9AKMT2AMEN1KDM4ENPC1
SCHEMBL3759875 0.84 MAPT (1.00) RAB9AKMT2AMEN1KDM4EMAPT
Phosphoric Acid Monomethyl Ester SCHEMBL28508950 0.84 RAB9A (0.52) RAB9AKMT2AMEN1KDM4EMAPT
SCHEMBL6831731 0.83 MAPK10 (0.53) RAB9AKMT2AMEN1KDM4EMAPT
SCHEMBL4815674 0.82 ASIC3 (0.54) RAB9AKMT2AMEN1KDM4EMAPT
Hydrochloric Acid SCHEMBL4808551 0.81 ASIC3 (0.52) RAB9AKMT2AMEN1KDM4EMAPT
SCHEMBL1702423 0.80 HSD11B1 (0.57) RAB9AKMT2AMEN1KDM4EMAPT
SCHEMBL3952453 0.80 ABCB1 (0.58) RAB9AKMT2AMEN1KDM4EMAPT
SCHEMBL14293042 0.78 TDP1 (0.50) RAB9AKMT2AMEN1KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108276403-A A kind of synthetic method of Ka Bolin classes compound 贵州医科大学 2018-07-13 CN disclosed
CN-107216328-A A kind of synthetic method of α Ka Bolin class compounds 贵州医科大学 2017-09-29 CN disclosed
US-9011734-B2 Ligand exchange thermochromic, (LETC), systems PLEOTINT, L.L.C. (US) 2015-04-21 US disclosed
EP-2082005-B9 LIGAND EXCHANGE THERMOCHROMIC, (LETC), SYSTEMS PLEOTINT LLC (US) 2013-05-22 EP disclosed
US-8431045-B2 Ligand exchange thermochromic systems and high ε ligands for same PLEOTINT, L.L.C. (US) 2013-04-30 US disclosed
US-20120292581-A1 LIGAND EXCHANGE THERMOCHROMIC SYSTEMS AND HIGH E LIGANDS FOR SAME PLEOTINT, LLC (US) 2012-11-22 US disclosed
EP-2082005-B1 LIGAND EXCHANGE THERMOCHROMIC, (LETC), SYSTEMS PLEOTINT LLC (US) 2012-08-01 EP disclosed
US-8182718-B2 Ligand exchange thermochromic systems and high ε ligands for same PLEOTINT, L.L.C. (US) 2012-05-22 US disclosed
EP-2436750-A2 Ligand exchange thermochromic, (LETC), systems Pleotint, L.L.C. (US) 2012-04-04 EP disclosed
EP-2434000-A2 Ligand exchange thermochromic, (LETC), systems Pleotint, L.L.C. (US) 2012-03-28 EP disclosed
US-7538931-B2 Ligand exchange thermochromic systems containing exchange metals PLEOTINT, L.L.C. (US) 2009-05-26 US disclosed
US-7525717-B2 reversible; laminated; transition metal ion coordinated with a high epsilon ligand and a low epsilon ligand; polymer; separator; variable light transmission windows; polyvinyl butyral; nickel or cobalt iodide ligands; diol, triol or polyol ligands PLEOTINT, L.L.C. (US) 2009-04-28 US disclosed
US-20080105851-A1 Exhibiting a reversible change in absorbance of electromagnetic radiation as the temperature of the system is reversibly changed; comprising a transition metal ion and a ligand PLEOTINT, LLC (US) 2008-05-08 US disclosed
US-20080106781-A1 LIGAND EXCHANGE THERMOCHROMIC SYSTEMS CONTAINING EXCHANGE METALS PLEOTINT, LLC (US) 2008-05-08 US disclosed
US-20080100902-A1 LIGAND EXCHANGE THERMOCHROMIC, (LETC), SYSTEMS PLEOTINT, LLC (US) 2008-05-01 US disclosed
US-20080100903-A1 MULTI-LAYER LIGAND EXCHANGE THERMOCHROMIC SYSTEMS PLEOTINT, LLC (US) 2008-05-01 US disclosed
WO-2008028128-A1 LIGAND EXCHANGE THERMOCHROMIC, (LETC), SYSTEMS PLEOTINT, L.L.C. (US) 2008-03-06 WO disclosed
US-6235730-B1 ANTICHOLESTEROL AGENT, ANTILIPEMIC AGENT JAPAN TOBACCO, INC. (JP) 2001-05-22 US disclosed
EP-0970954-A1 3-PIPERIDYL-4-OXOQUINAZOLINE DERIVATIVES AND MEDICINCAL COMPOSITIONS CONTAINING THE SAME JAPAN TOBACCO INC. (JP) 2000-01-12 EP disclosed
EP-0000816-A1 Substituted amino-pyridine derivatives, processes for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1979-02-21 EP disclosed