SCHEMBL7569216

SCHEMBL7569216

CCCCCCCCCCCCCCCCCCOc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 4/20 0.60
THRA P10827 1/20 0.58
THRB P10828 1/20 0.58
MAPT P10636 5/20 0.55
LMNA P02545 3/20 0.55
NPSR1 Q6W5P4 2/20 0.55
CYSLTR2 Q9NS75 1/20 0.55
CYSLTR1 Q9Y271 1/20 0.55
PLA2G4B P0C869 1/20 0.54
PRSS1 P07477 4/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
ALDH1A1 P00352 3/20 0.51
TDP1 Q9NUW8 1/20 0.51
GAA P10253 1/20 0.51
KMT2A Q03164 1/20 0.50
ALPG P10696 1/20 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
SCHEMBL8973848 1.00 CYP19A1 (0.60) CYP19A1THRATHRBMAPTLMNA
SCHEMBL8973648 1.00 CYP19A1 (0.60) CYP19A1THRATHRBMAPTLMNA
SCHEMBL8973675 1.00 CYP19A1 (0.60) CYP19A1THRATHRBMAPTLMNA
SCHEMBL11572440 1.00 CYP19A1 (0.60) CYP19A1THRATHRBMAPTLMNA
SCHEMBL7786961 1.00 CYP19A1 (0.60) CYP19A1THRATHRBMAPTLMNA
SCHEMBL8973693 0.98 CYP19A1 (0.57) CYP19A1THRATHRBMAPTLMNA
SCHEMBL8973683 0.94 ALDH1A1 (0.56) CYP19A1THRATHRBMAPTLMNA
SCHEMBL8973132 0.89 CYP19A1 (0.57) CYP19A1MAPTLMNANPSR1SMN1; SMN2
SCHEMBL7573078 0.88 CYP19A1 (0.63) CYP19A1THRATHRBMAPTLMNA
SCHEMBL9165752 0.88 CYP19A1 (0.66) CYP19A1THRATHRBMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0890131-B1 PROCESS AND MATERIALS FOR INDUCING PRE-TILT IN LIQUID CRYSTALS AND LIQUID CRYSTAL DISPLAYS ELSICON INC INC IN DELAWARE US (US) 2002-09-11 EP disclosed
US-6046303-A MADE BY ADDING DIOXOTETRAHYDROFURAN 3-METHYLCYCLOHEXENE-1,2-DICARBOXYLIC DIANHYDRIDE TO A MIXTURE OF AROMATIC TETRACARBOXYLIC DIANHYDRIDES AND AROMATIC DIAMINES HAVING ALKOXY SIDE CHAINS; FOR LIQUID CRYSTAL ALIGNMENT LAYER KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2000-04-04 US disclosed
US-5929201-A A POLYAMIC ACID IS THE REACTION PRODUCT OF A FLUORINATED MONOAMINE, A DIAMINE AND ATLEAST ONE TETERACARBOXYLIC DIANHYDRIDE ELSICON, INC. (US) 1999-07-27 US disclosed
EP-0890131-A2 PROCESS AND MATERIALS FOR INDUCING PRE-TILT IN LIQUID CRYSTALS AND LIQUID CRYSTAL DISPLAYS ALLIANT TECHSYSTEMS INC. (US) 1999-01-13 EP disclosed
US-5856430-A Process and materials for inducing pre-tilt in liquid crystals and liquid crystal displays ALLIANT TECHSYSTEMS INC. (US) 1999-01-05 US disclosed
US-5856431-A POLYIMIDE ALLIANT TECHSYSTEMS INC. (US) 1999-01-05 US disclosed
US-5817743-A ANISOTROPICALLY ABSORBING MOLECULES, POLARIZED LIGHT ALLIANT TECHSYSTEMS INC. (US) 1998-10-06 US disclosed
US-5731405-A POLYIMIDE COPOLYMER MADE FROM DIARYL KETONE TETRACARBOXYLIC DIANHYDRIDE, HYDROPHOBIC DIAMINE, AND ALICYCLIC TETRACARBOXYLIC ANHYDRIDE REACTANTS ALLIANT TECHSYSTEMS INC. (US) 1998-03-24 US disclosed
WO-1997037273-A2 PROCESS AND MATERIALS FOR INDUCING PRE-TILT IN LIQUID CRYSTALS AND LIQUID CRYSTAL DISPLAYS ALLIANT TECHSYSTEMS INC. (US) 1997-10-09 WO disclosed