SCHEMBL8465664

SCHEMBL8465664

N#Cc1cccc(Oc2ccccc2N)c1Oc1ccccc1N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
MAPT P10636 1/20 0.50
CRHBP P24387 1/20 0.50
CRHR2 Q13324 1/20 0.50
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
GAA P10253 4/20 0.40
ALDH1A1 P00352 3/20 0.40
POLB P06746 1/20 0.40
RCE1 Q9Y256 1/20 0.39
ADRA2B P18089 1/20 0.38
PTGS1 P23219 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
PLAU P00749 1/20 0.36
MAP4K4 O95819 1/20 0.36
TLR4 O00206 1/20 0.35
TSHR P16473 1/20 0.34
IKBKB O14920 2/20 0.34

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
SCHEMBL9131619 0.85 GAA (0.53) KDM4EMAPTCRHBPCRHR2CYP1A2
SCHEMBL30487034 0.83 SMN1; SMN2 (0.45) KDM4EMAPTCRHBPCRHR2CYP1A2
SCHEMBL7125722 0.83 SMN1; SMN2 (0.45) KDM4EMAPTCRHBPCRHR2CYP1A2
SCHEMBL28719491 0.82 GAA (0.50) KDM4EMAPTCRHBPCRHR2CYP1A2
SCHEMBL10717036 0.80 KDM4E (0.48) KDM4EMAPTCRHBPCRHR2CYP1A2
SCHEMBL22470427 0.79 MAPT (0.46) KDM4EMAPTCRHBPCRHR2CYP1A2
SCHEMBL30968574 0.79 MAPT (0.46) KDM4EMAPTCRHBPCRHR2CYP1A2
SCHEMBL9742046 0.75 GAA (0.50) KDM4EMAPTCYP3A4GAAALDH1A1
SCHEMBL30979203 0.74 KDM4E (0.65) KDM4EMAPTCRHBPCRHR2CYP1A2
SCHEMBL29508342 0.74 KDM4E (0.65) KDM4EMAPTCRHBPCRHR2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0659802-B1 Polyimide MITSUI CHEMICALS INC (JP) 1999-03-17 EP disclosed
US-5631377-A LONG-CHAIN AROMATIC DIAMINE MONOMER; MELT PROCESSABILITY, HEAT RESISTANCE MITSUI TOATSU CHEMICALS, INC. (JP) 1997-05-20 US disclosed
US-5508377-A IMPROVED PROCESSABILITY, HEAT RESISTANCE; ELECTRONICS, STRUCTURAL MATERIALS MITSUI TOATSU CHEMICALS, INC. (JP) 1996-04-16 US disclosed
EP-0659802-A1 Polyimide MITSUI TOATSU CHEMICALS, Inc. (JP) 1995-06-28 EP disclosed
EP-0397023-A3 CROSSLINKABLE POLYIMIDES FROM BIS (AMINOPHENOXY) BENZONITRILES HOECHST CELANESE CORPORATION (US) 1992-05-06 EP disclosed
US-5101005-A Improved solvent resistance, nitrile containing diamine HOECHST CELANESE CORP. (US) 1992-03-31 US disclosed
EP-0397023-A2 Crosslinkable polyimides from bis (aminophenoxy) benzonitriles HOECHST CELANESE CORPORATION (US) 1990-11-14 EP disclosed
EP-0397023-A2 Crosslinkable polyimides from bis (aminophenoxy) benzonitriles HOECHST CELANESE CORPORATION (US) 1990-11-14 EP disclosed