SCHEMBL4047506

SCHEMBL4047506

Oc1cc(O)c2cc3ccccc3nc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 2/20 0.53
ALDH1A1 P00352 5/20 0.52
MAPT P10636 4/20 0.52
HPGD P15428 3/20 0.52
GLA P06280 3/20 0.52
ACHE P22303 1/20 0.52
GAA P10253 5/20 0.48
KDM4E B2RXH2 4/20 0.48
STAT3 P40763 1/20 0.48
KMT2A Q03164 5/20 0.47
RAB9A P51151 3/20 0.47
NPC1 O15118 2/20 0.47
POLB P06746 2/20 0.47
LMNA P02545 1/20 0.47
PTBP1 P26599 1/20 0.47
RCE1 Q9Y256 1/20 0.47
MYC P01106 1/20 0.46
MAX P61244 1/20 0.46
ESR1 P03372 4/20 0.45
ESR2 Q92731 4/20 0.45

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
SCHEMBL31405517 0.81 ALDH1A1 (0.50) NQO2ALDH1A1MAPTHPGDGLA
SCHEMBL28055298 0.81 ALDH1A1 (0.55) NQO2ALDH1A1MAPTHPGDGLA
SCHEMBL6430599 0.81 NQO2 (0.44) NQO2ALDH1A1HPGDKDM4EKMT2A
SCHEMBL8204954 0.81 MYC (0.59) NQO2ALDH1A1MAPTHPGDGLA
SCHEMBL189031 0.80 ALDH1A1 (0.60) NQO2ALDH1A1MAPTHPGDGLA
SCHEMBL11067469 0.74 ALDH1A1 (0.65) NQO2ALDH1A1MAPTHPGDGLA
SCHEMBL1504343 0.73 ALDH1A1 (0.52) NQO2ALDH1A1MAPTHPGDGLA
SCHEMBL31410084 0.73 ALDH1A1 (0.52) NQO2ALDH1A1MAPTHPGDGLA
SCHEMBL25396678 0.73 KMT2A (0.40) ALDH1A1MAPTHPGDGLAACHE
SCHEMBL19260692 0.73 ALDH1A1 (0.47) NQO2ALDH1A1MAPTHPGDGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009026858-A1 DERIVATIVES OF ACRIDINONE AS ANTI-PARASITIC, ANTI-FUNGAL AND ANTI-VIRAL AGENTS CENTRO DE QUIMICA FARMACEUTICA (CU) 2009-03-05 WO disclosed
EP-0872903-B1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder SHINETSU CHEMICAL CO (JP) 2001-10-04 EP disclosed
US-6277519-B1 QUENCHING AN ALLOY MELT; COMMINUTION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2001-08-21 US disclosed
US-6096144-A TREATING WITH ACIDIC OR ALKALINE SOLUTION OF CONJUGATED UNSATURATED COMPOUND WITH AT LEAST 5 BONDS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2000-08-01 US disclosed
US-5858571-A TREATING A PULVERIZED HYDROGEN ABSORBING ALLOY WITH A SOLUTION COMPRISING A CONJUGATED UNSATURATED COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 1999-01-12 US disclosed
EP-0872903-A1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder Shin-Etsu Chemical Co., Ltd. (JP) 1998-10-21 EP disclosed
EP-0172427-B1 PROCESS FOR PRODUCTION OF VINYL CHLORIDE POLYMER Shin-Etsu Chemical Co., Ltd. (JP) 1989-07-05 EP disclosed
US-4758639-A Process for production of vinyl polymer SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-19 US disclosed
US-4757124-A Suspension or emulsion polymerizing vinyl chloride monomer or mixture of vinyl chloride with vinyl monomer copolymerizable therewith in reactor with walls coated with antiscaling compound containing dye or pigments SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-12 US disclosed
EP-0172427-A2 Process for production of vinyl chloride polymer Shin-Etsu Chemical Co., Ltd. (JP) 1986-02-26 EP disclosed